SCHEMBL10128974

SCHEMBL10128974

Nc1ccc(/C=C/c2cccc3ccccc23)cc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHAT P28329 4/20 0.60
CYP19A1 P11511 3/20 0.55
MAOA P21397 1/20 0.55
MAOB P27338 1/20 0.55
PTGS1 P23219 1/20 0.53
PTGS2 P35354 1/20 0.53
CHRNB4 P30926 1/20 0.48
CHRNA3 P32297 1/20 0.48
CHRNA7 P36544 1/20 0.48

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
SCHEMBL9168725 0.90 CHAT (0.70) CHATPTGS1PTGS2
SCHEMBL9168728 0.90 CHAT (0.70) CHATPTGS1PTGS2
SCHEMBL10892972 0.88 CYP19A1 (0.58) CHATCYP19A1MAOAMAOB
SCHEMBL10892976 0.88 CYP19A1 (0.58) CHATCYP19A1MAOAMAOB
SCHEMBL27794704 0.84 CYP19A1 (0.50) CHATCYP19A1MAOAMAOBPTGS1
SCHEMBL1782982 0.84 CHAT (0.68) CHATPTGS1PTGS2
SCHEMBL6051064 0.84 CHAT (0.68) CHATPTGS1PTGS2
SCHEMBL10892901 0.84 CYP19A1 (0.64) CYP19A1MAOAMAOB
SCHEMBL10892894 0.84 CYP19A1 (0.64) CYP19A1MAOAMAOB
SCHEMBL2774767 0.84 CHAT (0.68) CHATPTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9082995-B2 Organic EL element and organic EL material-containing solution IDEMITSU KOSAN CO., LTD. (JP) 2015-07-14 US disclosed
US-9082995-B2 Organic EL element and organic EL material-containing solution IDEMITSU KOSAN CO., LTD. (JP) 2015-07-14 US disclosed
US-20130187143-A1 ORGANIC EL DEVICE AND ANTHRACENE DERIVATIVE NISHIMURA KAZUKI (JP) 2013-07-25 US disclosed
US-8426036-B2 Organic EL device and anthracene derivative IDEMITSU KOSAN CO., LTD. (JP) 2013-04-23 US disclosed
US-8426036-B2 Organic EL device and anthracene derivative IDEMITSU KOSAN CO., LTD. (JP) 2013-04-23 US disclosed
US-8294142-B2 Organic EL device IDEMITSU KOSAN CO., LTD. (JP) 2012-10-23 US disclosed
US-8207526-B2 Organic EL device IDEMITSU KOSAN CO., LTD. (JP) 2012-06-26 US disclosed
US-20100270539-A1 ORGANIC EL ELEMENT AND ORGANIC EL MATERIAL-CONTAINING SOLUTION IDEMITSU KOSAN CO., LTD. (JP) 2010-10-28 US disclosed
US-20100207110-A1 ORGANIC EL DEVICE IDEMITSU KOSAN CO. LTD (JP) 2010-08-19 US disclosed
US-20100187517-A1 ORGANIC EL DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-07-29 US disclosed
US-20100171109-A1 ORGANIC EL DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-07-08 US disclosed
US-20100044689-A1 ORGANIC EL DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-02-25 US disclosed