SCHEMBL4028781

SCHEMBL4028781

Cc1noc(-c2ccc(Cl)nc2)c1N(C(=O)O)C(C)c1ccccc1Cl

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 7/20 0.42
LPAR3 Q9UBY5 4/20 0.42
LPAR2 Q9HBW0 2/20 0.42
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KCNQ3 O43525 2/20 0.32
KCNQ2 O43526 2/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
CTSA P10619 1/20 0.32

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
SCHEMBL4034108 0.89 LPAR1 (0.44) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4034159 0.89 LPAR1 (0.44) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL15437576 0.87 LPAR1 (0.43) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4032476 0.87 LPAR1 (0.43) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4032395 0.86 LPAR1 (0.40) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4032913 0.85 LPAR1 (0.42) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4033894 0.85 LPAR1 (0.44) LPAR1LPAR3LPAR2MAPTNPC1
SCHEMBL4034499 0.85 LPAR1 (0.48) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4036790 0.84 TRPA1 (0.46) LPAR1LPAR3LPAR2MAPTKDM4E
SCHEMBL4035057 0.84 TP53 (0.41) 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