SCHEMBL9309848

SCHEMBL9309848

CCOC(=O)c1ccccc1-c1oc2ccc(C)cc2c1Br

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.53
NPC1 O15118 2/20 0.48
RAB9A P51151 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
PTGS2 P35354 2/20 0.47
KDM4E B2RXH2 5/20 0.46
ALDH1A1 P00352 3/20 0.46
GAA P10253 2/20 0.46
GLA P06280 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TSHR P16473 1/20 0.46
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
HPGD P15428 2/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL7303033 0.89 NPC1 (0.46) ALOX5NPC1RAB9AKDM4EALDH1A1
SCHEMBL7302152 0.88 KDM4E (0.46) ALOX5NPC1RAB9ARXFP1KDM4E
SCHEMBL9313939 0.88 ALOX5 (0.50) ALOX5PTGS2KDM4EALDH1A1GAA
SCHEMBL7302852 0.85 KDM4E (0.44) ALOX5NPC1RAB9APTGS2KDM4E
SCHEMBL9309854 0.85 TSHR (0.47) ALOX5NPC1RAB9ARXFP1KDM4E
SCHEMBL7312942 0.84 KDM4E (0.62) NPC1RAB9AKDM4EALDH1A1GAA
SCHEMBL9308867 0.77 AGTR1 (0.49)
SCHEMBL9571330 0.76 CYP4F2 (0.53) ALOX5PTGS2KDM4EALDH1A1GAA
SCHEMBL9309360 0.76 AGTR1 (0.51)
SCHEMBL8544446 0.76 HTT (0.45) ALOX5KDM4EALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5374646-A Treatment or prophylasix of hypertension and diseases associated with cognitive disorders GLAXO GROUP LIMITED (GB) 1994-12-20 US disclosed
EP-0434249-A2 Benzofuran derivatives GLAXO GROUP LIMITED (GB) 1991-06-26 EP disclosed