SCHEMBL4037272

SCHEMBL4037272

Cc1ccc(-c2onc(C)c2NC(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
KDM4E B2RXH2 3/20 0.54
LPAR1 Q92633 5/20 0.53
LPAR3 Q9UBY5 3/20 0.53
RAB9A P51151 4/20 0.47
MEN1 O00255 2/20 0.47
NPC1 O15118 2/20 0.47
KMT2A Q03164 2/20 0.47
POLB P06746 2/20 0.47
IP6K1 Q92551 2/20 0.47
IP6K3 Q96PC2 2/20 0.47
IP6K2 Q9UHH9 2/20 0.47
ABCC3 O15438 1/20 0.45
ABCC4 O15439 1/20 0.45
ABCB11 O95342 1/20 0.45
CYP2C8 P10632 1/20 0.45
CYP2C9 P11712 1/20 0.45
ABCB4 P21439 1/20 0.45
ABCC2 Q92887 1/20 0.45
SLCO1B3 Q9NPD5 1/20 0.45

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
SCHEMBL2761636 0.89 MAPT (0.53) MAPTKDM4ELPAR1LPAR3RAB9A
SCHEMBL4035675 0.89 MAPT (0.67) MAPTKDM4ELPAR1LPAR3MEN1
SCHEMBL4034870 0.88 MAPT (0.52) MAPTKDM4ELPAR1LPAR3RAB9A
SCHEMBL6003 0.88 LPAR1 (0.54) MAPTKDM4ELPAR1LPAR3RAB9A
SCHEMBL3710978 0.88 MAPT (0.52) MAPTKDM4ELPAR1LPAR3RAB9A
SCHEMBL12465807 0.88 MAPT (0.52) MAPTKDM4ELPAR1LPAR3RAB9A
SCHEMBL12467498 0.88 MAPT (0.52) MAPTKDM4ELPAR1LPAR3RAB9A
SCHEMBL25401241 0.86 MAPT (0.57) MAPTKDM4ELPAR1LPAR3RAB9A
SCHEMBL4028773 0.86 MAPT (0.53) MAPTKDM4ELPAR1LPAR3KMT2A
SCHEMBL12465722 0.85 MAPT (0.60) MAPTKDM4ELPAR1LPAR3RAB9A

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