SCHEMBL4034023

SCHEMBL4034023

Cc1noc(-c2ccc(COc3ccccc3)cc2)c1NC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 5/20 0.53
LPAR3 Q9UBY5 3/20 0.51
SMPD1 P17405 2/20 0.50
LPAR2 Q9HBW0 2/20 0.49
MAPT P10636 3/20 0.49
KDM4E B2RXH2 1/20 0.49
ALOX5 P09917 2/20 0.48
ALOX5AP P20292 2/20 0.48
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
LMNA P02545 2/20 0.44
ALDH1A1 P00352 1/20 0.44
ABCC3 O15438 1/20 0.44
ABCC4 O15439 1/20 0.44
ABCB11 O95342 1/20 0.44
CYP2C8 P10632 1/20 0.44
CYP2C9 P11712 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
SCHEMBL4033885 0.85 LPAR1 (0.52) LPAR1LPAR3SMPD1LPAR2MAPT
SCHEMBL4029162 0.82 LPAR1 (0.78) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4035675 0.82 MAPT (0.67) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL3706068 0.80 MAPT (0.52) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL2761636 0.79 MAPT (0.53) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4042302 0.79 LPAR1 (0.47) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4033791 0.78 LPAR1 (0.52) LPAR1LPAR3MAPTKDM4EMEN1
SCHEMBL4029416 0.78 LPAR1 (0.46) LPAR1LPAR3SMPD1LPAR2MAPT
SCHEMBL4029141 0.78 LPAR1 (0.62) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4037272 0.78 MAPT (0.54) LPAR1LPAR3LPAR2MAPTKDM4E

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
EP-1258484-B1 NOVEL ISOXAZOLE AND THIAZOLE COMPOUNDS AND USE THEREOF AS DRUGS KYOWA HAKKO KIRIN CO LTD (JP) 2009-01-14 EP claimed