SCHEMBL66561

SCHEMBL66561

c1ccc(CN(c2ccc(-c3ccccc3)cc2)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.54
NR3C2 P08235 1/20 0.50
CYP2C19 P33261 1/20 0.45
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
CNR2 P34972 2/20 0.44
PTGES O14684 1/20 0.44
ALOX5 P09917 1/20 0.44
KCNA3 P22001 1/20 0.44
PYCR1 P32322 1/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
CYP19A1 P11511 1/20 0.42
AOC3 Q16853 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14373647 1.00 TAAR1 (0.54) TAAR1NR3C2CYP2C19TSHRALDH1A1
SCHEMBL1702260 0.95 NR3C2 (0.54) TAAR1NR3C2CYP2C19TSHRALDH1A1
SCHEMBL23992546 0.93 TAAR1 (0.57) TAAR1NR3C2TSHRHDAC1HDAC8
SCHEMBL13241961 0.90 CYP2C19 (0.61) TAAR1NR3C2CYP2C19TSHRALDH1A1
SCHEMBL17735825 0.90 CYP2C19 (0.61) TAAR1NR3C2CYP2C19TSHRALDH1A1
SCHEMBL25823394 0.90 NR3C2 (0.50) TAAR1NR3C2CYP2C19TSHRALDH1A1
SCHEMBL21126417 0.90 TAAR1 (0.53) TAAR1NR3C2CYP2C19TSHRALDH1A1
SCHEMBL23435088 0.90 NR3C2 (0.50) TAAR1NR3C2CYP2C19TSHRALDH1A1
SCHEMBL9215743 0.88 TAAR1 (0.56) TAAR1NR3C2TSHRALDH1A1HDAC1
SCHEMBL9446230 0.88 NR3C2 (0.59) TAAR1NR3C2CYP2C19TSHRALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 77 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11751472-B2 Aromatic amine derivative and elecroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2023-09-05 US disclosed
US-11538997-B2 Aromatic amine derivative and electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2022-12-27 US disclosed
US-20220336749-A9 AROMATIC AMINE DERIVATIVE AND ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD (JP) 2022-10-20 US disclosed
US-20220271231-A1 AROMATIC AMINE DERIVATIVE AND ELECROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2022-08-25 US disclosed
US-10446761-B2 Aromatic amine derivative and electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2019-10-15 US disclosed
US-20190081245-A1 AROMATIC AMINE DERIVATIVE AND ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2019-03-14 US disclosed
EP-2639231-B1 Aromatic amine derivative, and organic electroluminescence element using the same IDEMITSU KOSAN CO (JP) 2019-02-06 EP disclosed
US-10158084-B2 Aromatic amine derivative and electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2018-12-18 US disclosed
US-10153435-B2 Aromatic amine derivative and electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2018-12-11 US disclosed
US-20170294588-A1 AROMATIC AMINE DERIVATIVE AND ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2017-10-12 US disclosed
US-20070111028-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-05-17 US disclosed
US-20070075635-A1 Organic electroluminescent device IDEMITSU KOSAN CO., LTD. (JP) 2007-04-05 US disclosed
EP-1768199-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-03-28 EP disclosed
US-20060159957-A1 Aromatic amine derivative and organic electroluminescence device employing the same IDEMITSU KOSAN CO., LTD. (JP) 2006-07-20 US disclosed
US-20060134458-A1 Aromatic amine derivative and organic electroluminescence element IDEMITSU KOSAN CO., LTD. (JP) 2006-06-22 US disclosed
US-20060063952-A1 Method for producing aromatic diamine derivative IDEMITSU KOSAN CO., LTD. (JP) 2006-03-23 US disclosed
US-20060030736-A1 Method for producing aromatic amino compound IDEMITSU KOSAN CO., LTD. (JP) 2006-02-09 US disclosed
EP-1593665-A1 METHOD FOR PRODUCING AROMATIC DIAMINE DERIVATIVE IDEMITSU KOSAN CO., LTD. (JP) 2005-11-09 EP disclosed
EP-1584614-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2005-10-12 EP disclosed
US-20040082813-A1 Method for producting aromatic amino compound IDEMITSU KOSAN CO., LTD. (JP) 2004-04-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (15 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10446761-B2 Aromatic amine derivative and electroluminescence device using the same EML4, DDC, TYR TAAR1 163/4885NR3C2 4609/4885CYP2C19 1186/4885
US-11751472-B2 Aromatic amine derivative and elecroluminescence device using the same ALK, ALKBH3, ACVRL1 TAAR1 139/4885NR3C2 4401/4885CYP2C19 359/4885
US-20060159957-A1 Aromatic amine derivative and organic electroluminescence device employing the same OPA1, MAOA, AOC2 TAAR1 421/4885NR3C2 4515/4885CYP2C19 672/4885
US-20060030736-A1 Method for producing aromatic amino compound SLC7A1, SLC43A1, AHR TAAR1 74/4885NR3C2 1557/4885CYP2C19 626/4885
US-20190081245-A1 AROMATIC AMINE DERIVATIVE AND ELECTROLUMINESCENCE DEVICE USING THE SAME EML4, DDC, TYR TAAR1 163/4885NR3C2 4609/4885CYP2C19 1186/4885
US-20170294588-A1 AROMATIC AMINE DERIVATIVE AND ELECTROLUMINESCENCE DEVICE USING THE SAME MAOA, SETD1A, EML4 TAAR1 143/4885NR3C2 4649/4885CYP2C19 1809/4885
US-11538997-B2 Aromatic amine derivative and electroluminescence device using the same EML4, DDC, TYR TAAR1 163/4885NR3C2 4609/4885CYP2C19 1186/4885
US-20070111028-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME EML4, TYR, OCIAD2 TAAR1 329/4885NR3C2 3627/4885CYP2C19 1131/4885
US-20220271231-A1 AROMATIC AMINE DERIVATIVE AND ELECROLUMINESCENCE DEVICE USING THE SAME ALK, ALKBH3, ACVRL1 TAAR1 139/4885NR3C2 4401/4885CYP2C19 359/4885
US-10153435-B2 Aromatic amine derivative and electroluminescence device using the same MAOA, SETD1A, EML4 TAAR1 143/4885NR3C2 4649/4885CYP2C19 1809/4885
US-20040082813-A1 Method for producting aromatic amino compound ADRM1, SLC7A1, AHR TAAR1 31/4885NR3C2 223/4885CYP2C19 750/4885
US-20060134458-A1 Aromatic amine derivative and organic electroluminescence element TYR, SLC18A1, MAOA TAAR1 127/4885NR3C2 3118/4885CYP2C19 1172/4885
US-10158084-B2 Aromatic amine derivative and electroluminescence device using the same MAOA, SETD1A, EML4 TAAR1 133/4885NR3C2 4661/4885CYP2C19 1728/4885
US-20060063952-A1 Method for producing aromatic diamine derivative NAT1, AHR, AADAC TAAR1 51/4885NR3C2 174/4885CYP2C19 698/4885
US-20220336749-A9 AROMATIC AMINE DERIVATIVE AND ELECTROLUMINESCENCE DEVICE USING THE SAME EML4, DDC, TYR TAAR1 163/4885NR3C2 4609/4885CYP2C19 1186/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.