SCHEMBL2336066

SCHEMBL2336066

CCOC(=O)N(c1ccccc1Cl)c1c(C)noc1-c1ccc(-c2ccc(CCC(=O)O)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 3/20 0.41
LPAR2 Q9HBW0 2/20 0.41
LPAR3 Q9UBY5 2/20 0.41
FFAR1 O14842 11/20 0.39
NR1H4 Q96RI1 2/20 0.38
FFAR4 Q5NUL3 4/20 0.38
FABP1 P07148 1/20 0.38
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
RXRG P48443 1/20 0.35
PPARD Q03181 1/20 0.35

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
SCHEMBL2334588 0.95 LPAR1 (0.40) LPAR1LPAR2LPAR3FFAR1NR1H4
SCHEMBL2341943 0.93 CYP4F2 (0.39) LPAR1LPAR2LPAR3FFAR4
SCHEMBL2338262 0.91 LPAR1 (0.50) LPAR1LPAR2LPAR3NR1H4FABP1
SCHEMBL2338119 0.89 ALOX5 (0.40) LPAR1LPAR2LPAR3FFAR4
SCHEMBL3704161 0.87 LPAR1 (0.47) LPAR1LPAR2LPAR3NR1H4FABP1
SCHEMBL2339543 0.87 LPAR1 (0.42) LPAR1LPAR2LPAR3
SCHEMBL2335317 0.87 LPAR1 (0.38) LPAR1LPAR2LPAR3NR1H4
SCHEMBL3700609 0.86 LPAR1 (0.46) LPAR1LPAR2LPAR3NR1H4FABP1
SCHEMBL2336634 0.85 LPAR1 (0.43) LPAR1LPAR2LPAR3
SCHEMBL1247211 0.85 FFAR4 (0.42) FFAR1NR1H4FFAR4FABP1PPARD

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-2010077882-A2 ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-07-08 WO disclosed
WO-2010077883-A2 ANTAGONISTS OF LYSOPHOSPHATIDIC ACID RECEPTORS AMIRA PHARMACEUTICALS, INC. (US) 2010-07-08 WO disclosed