SCHEMBL16348398

SCHEMBL16348398

CCCCOCc1coc(-c2cc(Cl)ccc2OC(C(=O)O)c2ccc(Cl)cc2)n1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.43
PPARG P37231 6/20 0.43
P2RX7 Q99572 1/20 0.35
FFAR1 O14842 1/20 0.35
PTGER1 P34995 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
CASP3 P42574 1/20 0.34
KMT2A Q03164 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
TSPO P30536 1/20 0.34

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
SCHEMBL16348442 0.96 PPARA (0.44) PPARAPPARGFFAR1PTGER1MEN1
SCHEMBL16348401 0.91 PPARG (0.47) PPARAPPARGFFAR1KDM4E
SCHEMBL16348402 0.90 PPARA (0.37) PPARAPPARGFFAR1PTGER1
SCHEMBL16348391 0.87 PPARG (0.48) PPARAPPARGFFAR1MEN1POLB
SCHEMBL16348377 0.86 PPARA (0.47) PPARAPPARGFFAR1KDM4EMEN1
SCHEMBL16348399 0.85 PPARG (0.47) PPARAPPARGFFAR1
SCHEMBL16348345 0.83 PPARA (0.41) PPARAPPARGFFAR1MEN1POLB
SCHEMBL16348390 0.82 PPARA (0.49) PPARAPPARGFFAR1KDM4EMEN1
SCHEMBL16348437 0.81 PPARA (0.47) PPARAPPARGKDM4EMEN1POLB
SCHEMBL16348439 0.79 PPARA (0.52) PPARAPPARGPTGER1KDM4EMEN1

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
US-7642358-B2 Substituted phenylacetic acids METABOLEX, INC. (US) 2010-01-05 US disclosed
US-7642358-B2 Substituted phenylacetic acids METABOLEX, INC. (US) 2010-01-05 US disclosed