SCHEMBL7831300

SCHEMBL7831300

CCOC(=O)c1nnn(Cc2ccc(OC)cc2)c1C(=O)c1ccc(C)cc1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
MAPT P10636 3/20 0.46
POLB P06746 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46
CYP19A1 P11511 2/20 0.46
ALOX15 P16050 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HSD17B10 Q99714 4/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
HPGD P15428 3/20 0.45
LMNA P02545 3/20 0.45
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 2/20 0.44
NPC1 O15118 1/20 0.44
RECQL P46063 1/20 0.43
UCHL1 P09936 1/20 0.43
PDE8B O95263 1/20 0.43
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL7815561 0.93 POLB (0.46) SMN1; SMN2MAPTPOLBRXFP1CYP19A1
SCHEMBL7824859 0.89 ALOX15 (0.48) MAPTPOLBRXFP1ALOX15L3MBTL1
SCHEMBL8067025 0.88 AKR1C3 (0.48) SMN1; SMN2MAPTPOLBRXFP1CYP19A1
SCHEMBL7816184 0.86 CYP19A1 (0.44) SMN1; SMN2MAPTPOLBRXFP1CYP19A1
SCHEMBL8067017 0.86 SMN1; SMN2 (0.48) SMN1; SMN2MAPTPOLBRXFP1CYP19A1
SCHEMBL7824701 0.85 ALOX15 (0.48) MAPTPOLBRXFP1ALOX15L3MBTL1
SCHEMBL8071479 0.85 CYP19A1 (0.54) SMN1; SMN2MAPTPOLBRXFP1CYP19A1
SCHEMBL8073234 0.84 MEN1 (0.44) SMN1; SMN2MAPTPOLBRXFP1ALOX15
SCHEMBL7823456 0.84 SMN1; SMN2 (0.44) SMN1; SMN2MAPTPOLBRXFP1CYP19A1
SCHEMBL8057631 0.83 POLB (0.46) SMN1; SMN2MAPTPOLBRXFP1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686636-B1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA CO (JP) 2001-04-04 EP disclosed
US-5840895-A INTERMEDIATES FOR ANTIALLERGENS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1998-11-24 US disclosed
US-5686442-A ANTIALLERGENS MEIJI SEIKA KABUSHIKI KAISHA (JP) 1997-11-11 US disclosed
EP-0686636-A1 TRICYCLIC BENZAZEPINE AND BENZOTHIAZEPINE DERIVATIVES MEIJI SEIKA KABUSHIKI KAISHA (JP) 1995-12-13 EP disclosed