SCHEMBL7816246

SCHEMBL7816246

COc1ccc(Cn2nnc(C(=O)O)c2C(=O)c2ccc(C(OC)OC)cc2N)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 3/20 0.44
MAPT P10636 2/20 0.44
PTGER4 P35408 1/20 0.43
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
PDE8B O95263 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
HSD17B10 Q99714 5/20 0.41
HPGD P15428 4/20 0.41
AKR1C3 P42330 7/20 0.40
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 3/20 0.40
RECQL P46063 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
SCHEMBL7826316 0.93 ALOX15 (0.46) ALOX15L3MBTL1POLBMAPTPTGER4
SCHEMBL7816893 0.87 POLB (0.44) ALOX15L3MBTL1POLBMAPTPTGER4
SCHEMBL7824859 0.87 ALOX15 (0.48) ALOX15L3MBTL1POLBMAPTMEN1
SCHEMBL7824951 0.86 PTGER4 (0.42) ALOX15L3MBTL1POLBMAPTPTGER4
SCHEMBL7823930 0.84 ALOX15 (0.48) ALOX15L3MBTL1POLBMAPTPTGER4
SCHEMBL7827499 0.84 ALOX15 (0.46) ALOX15L3MBTL1POLBMAPTMEN1
SCHEMBL7823949 0.84 ALOX15 (0.49) ALOX15L3MBTL1POLBMAPTPTGER4
SCHEMBL7827714 0.83 ALOX15 (0.51) ALOX15L3MBTL1POLBMAPTPTGER4
SCHEMBL7828246 0.81 POLB (0.49) ALOX15L3MBTL1POLBMAPTMEN1
SCHEMBL7824116 0.81 ALOX15 (0.48) ALOX15L3MBTL1POLBMAPTMEN1

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