SCHEMBL4034447

SCHEMBL4034447

CNC(=O)CSCc1ccc(-c2onc(C)c2NC(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 4/20 0.48
LPAR3 Q9UBY5 3/20 0.48
LPAR2 Q9HBW0 2/20 0.48
PKM P14618 1/20 0.46
MAPT P10636 4/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 4/20 0.42
KMT2A Q03164 2/20 0.42
NPSR1 Q6W5P4 1/20 0.39
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
ATM Q13315 2/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TSHR P16473 1/20 0.38
GAA P10253 1/20 0.38
SENP1 Q9P0U3 1/20 0.37

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
SCHEMBL4028419 0.86 LPAR1 (0.51) LPAR1LPAR3LPAR2PKMMAPT
SCHEMBL4034142 0.84 LPAR1 (0.54) LPAR1LPAR3LPAR2PKMMAPT
SCHEMBL4029346 0.83 LPAR1 (0.55) LPAR1LPAR3LPAR2PKMMAPT
SCHEMBL4029811 0.82 LPAR1 (0.57) LPAR1LPAR3LPAR2PKMMAPT
SCHEMBL4036686 0.82 LPAR1 (0.52) LPAR1LPAR3LPAR2PKMMAPT
SCHEMBL4029577 0.79 TSHR (0.52) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4032136 0.79 LPAR1 (0.77) LPAR1LPAR3LPAR2PKMMAPT
SCHEMBL3706068 0.78 MAPT (0.52) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4037272 0.76 MAPT (0.54) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4033885 0.76 LPAR1 (0.52) 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