SCHEMBL2337495

SCHEMBL2337495

CCOC(=O)N(c1ccc(Cl)cc1F)c1c(C)noc1-c1ccc(-c2ccc(CC(=O)O)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 2/20 0.40
LPAR2 Q9HBW0 1/20 0.40
LPAR3 Q9UBY5 1/20 0.40
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PPARD Q03181 6/20 0.37
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
DGAT1 O75907 1/20 0.34
SOAT1 P35610 1/20 0.34
MME P08473 1/20 0.34
ACE P12821 1/20 0.34
RXRA P19793 2/20 0.34
RXRB P28702 2/20 0.34
RXRG P48443 2/20 0.34
FFAR4 Q5NUL3 1/20 0.34
ALOX5 P09917 1/20 0.33
ALOX5AP P20292 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
SCHEMBL2334207 0.93 ALDH1A1 (0.42) LPAR1LPAR2LPAR3ALDH1A1KDM4E
SCHEMBL2333294 0.91 LPAR1 (0.43) LPAR1LPAR2LPAR3ALDH1A1KDM4E
SCHEMBL2337987 0.91 LPAR1 (0.40) LPAR1LPAR2LPAR3DGAT1SOAT1
SCHEMBL2343129 0.89 LPAR1 (0.39) LPAR1LPAR2LPAR3KDM4EPPARD
SCHEMBL2341313 0.88 LPAR1 (0.40) LPAR1LPAR2LPAR3ALDH1A1KDM4E
SCHEMBL2335539 0.87 LPAR1 (0.45) LPAR1LPAR2LPAR3KDM4EDGAT1
SCHEMBL1246439 0.86 PPARD (0.37) ALDH1A1PPARDPPARGPPARADGAT1
SCHEMBL2341053 0.85 LPAR1 (0.42) LPAR1LPAR2LPAR3ALDH1A1KDM4E
SCHEMBL3712524 0.84 LPAR1 (0.42) LPAR1LPAR2LPAR3ALDH1A1KDM4E
SCHEMBL2337997 0.84 ALDH1A1 (0.43) LPAR1LPAR2LPAR3ALDH1A1KDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2358688-A2 ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS Amira Pharmaceuticals, Inc. (US) 2011-08-24 EP claimed
WO-2010077883-A2 ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-07-08 WO claimed
EP-2358688-A2 ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS Amira Pharmaceuticals, Inc. (US) 2011-08-24 EP disclosed
WO-2010077883-A2 ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-07-08 WO disclosed
WO-2010077882-A2 ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-07-08 WO disclosed