SCHEMBL866909

SCHEMBL866909

CCc1c[c]c(-c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.44
CYP1A2 P05177 1/20 0.36
CYP2A6 P11509 1/20 0.36
TAAR1 Q96RJ0 2/20 0.35
MAPT P10636 3/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
POLB P06746 1/20 0.32
KIF11 P52732 1/20 0.32
BCL2 P10415 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ABCC4 O15439 1/20 0.31

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
SCHEMBL5010976 0.85 HSD11B1 (0.36) TP53TAAR1MAPTNPC1RAB9A
SCHEMBL27908025 0.81 MAOB (0.36) TP53CYP1A2TAAR1MAPTNPC1
SCHEMBL27351758 0.80 TAAR1 (0.54) CYP2A6TAAR1KIF11
SCHEMBL1775203 0.80 TSHR (0.44) TAAR1RAB9ALMNASMN1; SMN2ABCC4
SCHEMBL5656746 0.80 TSHR (0.44) TAAR1RAB9AALDH1A1LMNAABCC4
SCHEMBL5783938 0.79 CYP3A4 (0.35) TP53CYP1A2TAAR1MAPTPPARG
SCHEMBL16143237 0.77 TAAR1 (0.38) CYP1A2TAAR1MAPTALDH1A1LMNA
SCHEMBL27741071 0.73 LMNA (0.44) TP53TAAR1MAPTNPC1RAB9A
SCHEMBL27474544 0.73 KDM4E (0.42) TP53CYP1A2MAPTNPC1RAB9A
SCHEMBL781962 0.72 LMNA (0.38) TP53MAPTNPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3156403-B1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO (JP) 2019-08-28 EP claimed
CN-109311844-B Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component 东曹株式会社 2021-07-20 CN disclosed
EP-3156403-B1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO (JP) 2019-08-28 EP disclosed
US-9972786-B2 Aromatic amine derivative, and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2018-05-15 US disclosed
EP-3156403-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT Idemitsu Kosan Co., Ltd (JP) 2017-04-19 EP disclosed
EP-2364980-B1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO (JP) 2017-01-04 EP disclosed
US-9196842-B2 Aromatic amine derivative and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2015-11-24 US disclosed
US-20150287931-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-10-08 US disclosed
US-9145363-B2 Aromatic amine derivative and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2015-09-29 US disclosed
US-20150255729-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2015-09-10 US disclosed
US-8614010-B2 Aromatic amine derivative, and organic electroluminescent element IDEMITSU KOSAN, CO., LTD. (JP) 2013-12-24 US disclosed
EP-2532655-A1 AMINOANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT FORMED USING SAME Idemitsu Kosan Co., Ltd. (JP) 2012-12-12 EP disclosed
US-20120299473-A1 AMINOANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT FORMED USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-11-29 US disclosed
US-20120175600-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-07-12 US disclosed
US-20120091438-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-04-19 US disclosed
US-20120074395-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2012-03-29 US disclosed
EP-2399906-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT Idemitsu Kosan Co., Ltd. (JP) 2011-12-28 EP disclosed
US-20110297924-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2011-12-08 US disclosed
US-20110278551-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2011-11-17 US disclosed
EP-2364980-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT Idemitsu Kosan Co., Ltd. (JP) 2011-09-14 EP 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 (6 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-20120175600-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT TYR, SLC7A5, SLC18A1 TP53 4278/4885CYP1A2 214/4885CYP2A6 2592/4885
US-20150287931-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT DDT, DDC, TYR TP53 3841/4885CYP1A2 271/4885CYP2A6 1816/4885
US-20120299473-A1 AMINOANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT FORMED USING SAME CCNT1, ARL1, RFT1 TP53 2721/4885CYP1A2 294/4885CYP2A6 1110/4885
US-20150255729-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT SLC7A5, ALKBH3, TYR TP53 4033/4885CYP1A2 119/4885CYP2A6 1891/4885
US-20110297924-A1 AROMATIC AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT SLC18A2, SLC18A1, SLC7A5 TP53 4217/4885CYP1A2 322/4885CYP2A6 1747/4885
US-20110278551-A1 AROMATIC AMINE DERIVATIVE, AND ORGANIC ELECTROLUMINESCENT ELEMENT SLC7A5, ALKBH3, TYR TP53 4033/4885CYP1A2 119/4885CYP2A6 1891/4885

“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.