SCHEMBL8080776

SCHEMBL8080776

Cc1ccc(-c2c3c(cc4ccc(C)cc24)C(=O)OC3=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.50
MAOB P27338 11/20 0.44
ADORA3 P0DMS8 2/20 0.44
GPR84 Q9NQS5 1/20 0.41
MAOA P21397 2/20 0.38
MIF P14174 1/20 0.38
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL7651428 0.79 ALOX5 (0.50) ALOX5MAOBADORA3GPR84MAOA
SCHEMBL8081262 0.75 ALOX5 (0.62) ALOX5MAOBADORA3GPR84MAOA
SCHEMBL31634574 0.75 SMN1; SMN2 (0.41) ALOX5MAOBADORA3GPR84MAOA
SCHEMBL30817881 0.74 ALOX5 (0.56) ALOX5MAOBGPR84KDM4EALDH1A1
SCHEMBL1270411 0.74 ALOX5 (0.56) ALOX5MAOBGPR84KDM4EALDH1A1
SCHEMBL9080061 0.71 TYMS (0.46) MAOBMAOAALDH1A1HPGDHSD17B10
SCHEMBL15024633 0.71 ALOX5 (0.39) ALOX5MAOBGPR84MAOAKDM4E
SCHEMBL15024628 0.69 MAOB (0.47) ALOX5MAOBADORA3GPR84MAOA
SCHEMBL10603083 0.68 CYP2A6 (0.50) MAOAKDM4EALDH1A1TP53MAPT
SCHEMBL15024463 0.67 CYP1A2 (0.40) ALOX5MAOBGPR84MAOAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6030967-A AND/OR LIKE NEUROTROPHIC FACTOR (FOR EXAMPLE, NERVE GROWTH FACTOR (NGF), BRAIN-DERIVED NEUROTROPHIC FACTOR, NEUROTROPHIN-3, AND GLIAL CELL LINE-DERIVED NEUROTROPHIC FACTOR)-LIKE ACTIVITY; OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-02-29 US disclosed