SCHEMBL12465973

SCHEMBL12465973

Cc1noc(-c2ccc(NS(C)(=O)=O)c(F)c2)c1NC(=O)O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
KDM4E B2RXH2 1/20 0.40
LPAR1 Q92633 1/20 0.39
LPAR3 Q9UBY5 1/20 0.39
KIT P10721 2/20 0.39
BRD4 O60885 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
SCHEMBL12465702 0.88 MAPT (0.44) MAPTKDM4ELPAR1LPAR3BRD4
SCHEMBL12465743 0.86 MAPT (0.47) MAPTKDM4ELPAR1LPAR3BRD4
SCHEMBL12465889 0.81 MAPT (0.53) MAPTKDM4ELPAR1LPAR3BRD4
SCHEMBL27931580 0.79 KIT (0.39) KIT
SCHEMBL15451657 0.79 LPAR1 (0.61) MAPTKDM4ELPAR1LPAR3
SCHEMBL12466023 0.77 KIT (0.41) MAPTKDM4EKITBRD4
SCHEMBL4034870 0.76 MAPT (0.52) MAPTKDM4ELPAR1LPAR3
SCHEMBL4037473 0.74 MAPT (0.51) MAPTKDM4ELPAR1LPAR3BRD4
SCHEMBL12467498 0.73 MAPT (0.52) MAPTKDM4ELPAR1LPAR3BRD4
SCHEMBL6003 0.73 LPAR1 (0.54) MAPTKDM4ELPAR1LPAR3

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
WO-2012100436-A1 COMPOUND AS ANTAGONIST OF LYSOPHOSPHATIDIC ACID RECEPTOR, COMPOSITION, AND USE THEREOF CUREGENIX INC. (CN) 2012-08-02 WO claimed
WO-2012100436-A1 COMPOUND AS ANTAGONIST OF LYSOPHOSPHATIDIC ACID RECEPTOR, COMPOSITION, AND USE THEREOF CUREGENIX INC. (CN) 2012-08-02 WO disclosed