SCHEMBL4034622

SCHEMBL4034622

CCc1noc(-c2ccccc2)c1N(C(=O)O)C(C)c1ccccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 4/20 0.38
LPAR3 Q9UBY5 3/20 0.38
LPAR2 Q9HBW0 2/20 0.38
HTT P42858 2/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PPARG P37231 1/20 0.33
PPARA Q07869 1/20 0.33
TP53 P04637 1/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2E1 P05181 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C8 P10632 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2A6 P11509 1/20 0.33

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
SCHEMBL4034389 0.90 TRPA1 (0.39) LPAR1LPAR3LPAR2LMNATP53
SCHEMBL4033456 0.89 LPAR1 (0.39) LPAR1LPAR3LPAR2HTTLMNA
SCHEMBL4034108 0.85 LPAR1 (0.44) LPAR1LPAR3LPAR2LMNANPSR1
SCHEMBL4034923 0.81 MEN1 (0.34) LPAR1LPAR3LPAR2LMNANPSR1
SCHEMBL4034159 0.80 LPAR1 (0.44) LPAR1LPAR3LPAR2HTTLMNA
SCHEMBL4032913 0.80 LPAR1 (0.42) LPAR1LPAR3LPAR2HTTLMNA
SCHEMBL4034499 0.79 LPAR1 (0.48) LPAR1LPAR3LPAR2MEN1KMT2A
SCHEMBL15437576 0.79 LPAR1 (0.43) LPAR1LPAR3LPAR2LMNAMEN1
SCHEMBL4032476 0.79 LPAR1 (0.43) LPAR1LPAR3LPAR2LMNATSHR
SCHEMBL4034918 0.78 LPAR1 (0.45) LPAR1LPAR3LPAR2TP53

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