SCHEMBL9971901

SCHEMBL9971901

Nc1ccc(-c2ccc(/C=C/c3ccccc3)c3ccccc23)c2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.44
CYP19A1 P11511 2/20 0.44
MAOA P21397 2/20 0.44
KDM4E B2RXH2 1/20 0.43
CHAT P28329 1/20 0.42
NFE2L2 Q16236 4/20 0.40
TRPA1 O75762 2/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
KEAP1 Q14145 1/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
DHFR P00374 1/20 0.40
HDAC3 O15379 1/20 0.38
IDO1 P14902 1/20 0.38
EP300 Q09472 1/20 0.38
KAT2B Q92831 1/20 0.38
KAT8 Q9H7Z6 1/20 0.38
NCOR2 Q9Y618 1/20 0.38
MEN1 O00255 1/20 0.37

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
SCHEMBL9971902 0.94 MAOB (0.48) MAOBCYP19A1MAOAKDM4ECHAT
SCHEMBL2502627 0.89 CHAT (0.50) MAOBCYP19A1MAOAKDM4ECHAT
SCHEMBL2502624 0.89 CHAT (0.50) MAOBCYP19A1MAOAKDM4ECHAT
SCHEMBL11215153 0.82 CHAT (0.55) MAOBCYP19A1MAOAKDM4ECHAT
SCHEMBL11259417 0.82 CHAT (0.55) MAOBCYP19A1MAOAKDM4ECHAT
SCHEMBL6178310 0.81 MAPT (0.60) KDM4ECHATLMNAMAPTHDAC3
SCHEMBL6178312 0.81 MAPT (0.60) KDM4ECHATLMNAMAPTHDAC3
SCHEMBL27879278 0.79 KDM4E (0.46) MAOBCYP19A1MAOAKDM4ECHAT
SCHEMBL7118094 0.76 NFE2L2 (0.58) MAOBCYP19A1MAOAKDM4ECHAT
SCHEMBL11544222 0.76 NFE2L2 (0.58) MAOBCYP19A1MAOAKDM4ECHAT

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120153815-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 US disclosed
US-20120153815-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 US disclosed
US-20110175521-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2011-07-21 US disclosed
US-20110175521-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2011-07-21 US disclosed
US-20100160687-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-06-24 US disclosed
US-20100160687-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-06-24 US disclosed
US-20070142671-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD (JP) 2007-06-21 US disclosed
EP-1775335-A2 Organic lectroluminescent element IDEMITSU KOSAN COMPANY LIMITED (JP) 2007-04-18 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 (4 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-20110175521-A1 ORGANIC ELECTROLUMESCENCE DEVICE SCO2, CHRM1, CHRM4 MAOB 739/4885CYP19A1 1811/4885MAOA 1500/4885
US-20100160687-A1 ORGANIC ELECTROLUMESCENCE DEVICE SCO2, CHRM1, CHRM4 MAOB 739/4885CYP19A1 1811/4885MAOA 1500/4885
US-20120153815-A1 ORGANIC ELECTROLUMINESCENCE DEVICE ARL1, RIF1, EML4 MAOB 1485/4885CYP19A1 788/4885MAOA 1025/4885
US-20070142671-A1 ORGANIC ELECTROLUMESCENCE DEVICE SCO2, CHRM1, CHRM4 MAOB 739/4885CYP19A1 1811/4885MAOA 1500/4885

“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.