SCHEMBL542971

SCHEMBL542971

COC(=O)c1cc(C#N)c2cc(OC)ccn12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 6/20 0.47
▸ FNTB P49356 6/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ BAZ2B Q9UIF8 2/20 0.42
▸ BAZ2A Q9UIF9 2/20 0.42
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ KDM4E B2RXH2 3/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PABPC1 P11940 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CASP3 P42574 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL343192 0.88 FNTA (0.44) FNTAFNTBL3MBTL1BAZ2BBAZ2A
SCHEMBL10123813 0.74 RXRA (0.45) KDM4E
SCHEMBL24510742 0.72 BAZ2B (0.55) FNTAFNTBL3MBTL1BAZ2BBAZ2A
SCHEMBL10123854 0.70 XDH (0.44) —
SCHEMBL17197313 0.69 CYP1A2 (0.56) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL4316682 0.69 CYP1A2 (0.56) CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19
SCHEMBL5622006 0.69 L3MBTL1 (0.56) L3MBTL1KDM4EALDH1A1MTNR1AMTNR1B
SCHEMBL344208 0.68 KDM4E (0.43) L3MBTL1KDM4EALDH1A1MEN1LMNA
SCHEMBL17339104 0.67 KDM4E (0.52) FNTAFNTBL3MBTL1CYP1A2CYP3A4
SCHEMBL24510741 0.66 BAZ2B (0.57) FNTAFNTBBAZ2BBAZ2ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748452-B2 Indolizine derivative and use thereof for medical purposes KISSEI PHARMACEUTICAL CO., LTD. (JP) 2014-06-10 — — US disclosed
EP-2415771-B1 INDOLIZINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES KISSEI PHARMACEUTICAL (JP) 2013-07-31 — — EP disclosed
EP-2415771-A1 INDOLIZINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES Kissei Pharmaceutical Co., Ltd. (JP) 2012-02-08 — — EP disclosed
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