SCHEMBL1247211

SCHEMBL1247211

CCOC(=O)N(c1ccccc1Cl)c1c(-c2ccc(-c3ccc(CCC(=O)O)cc3)cc2)noc1C

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.42
GPBAR1 Q8TDU6 3/20 0.41
FABP1 P07148 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
FFAR1 O14842 2/20 0.39
PPARD Q03181 4/20 0.39
PPARG P37231 3/20 0.38
PPARA Q07869 3/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 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
SCHEMBL1246285 0.95 PPARD (0.43) FFAR4GPBAR1FABP1NR1H4MAPT
SCHEMBL1245358 0.91 NR1H4 (0.42) GPBAR1FABP1NR1H4MAPTPPARD
SCHEMBL1245176 0.87 NR1H4 (0.40) GPBAR1FABP1NR1H4MAPTPPARD
SCHEMBL1247564 0.87 MAPT (0.42) GPBAR1NR1H4MAPTALDH1A1POLB
SCHEMBL1246477 0.86 NR1H4 (0.42) GPBAR1FABP1NR1H4MAPTPPARD
SCHEMBL1246467 0.86 NR1H4 (0.43) GPBAR1FABP1NR1H4PPARD
SCHEMBL2336066 0.85 LPAR1 (0.41) FFAR4FABP1NR1H4FFAR1PPARD
SCHEMBL1246442 0.85 ALDH1A1 (0.39) GPBAR1MAPTKMT2AALDH1A1HPGD
SCHEMBL1246476 0.85 NR1H4 (0.42) GPBAR1FABP1NR1H4MAPTPPARD
SCHEMBL1245294 0.85 GPBAR1 (0.37) GPBAR1MAPTMEN1KMT2AALDH1A1

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
EP-2462128-A2 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS Amira Pharmaceuticals, Inc. (US) 2012-06-13 EP claimed
WO-2011017350-A2 COMPOUNDS AS LYSOPHOSPHATIDIC ACID RECEPTOR ANTAGONISTS AMIRA PHARMACEUTICALS, INC. (US) 2011-02-10 WO claimed