SCHEMBL2319425

SCHEMBL2319425

Cc1ccc(C[C@@H](CC(=O)O)NC(=O)Cc2cccc(Cl)c2Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MME P08473 12/20 0.52
FFAR2 O15552 1/20 0.51
MMEL1 Q495T6 4/20 0.48
ITGB1 P05556 1/20 0.47
ITGA4 P13612 1/20 0.47
AVPR1A P37288 1/20 0.45
PSMB8 P28062 1/20 0.44
PSMB5 P28074 1/20 0.44
CTSG P08311 1/20 0.43
CMA1 P23946 1/20 0.43

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
SCHEMBL2319433 1.00 MME (0.52) MMEFFAR2MMEL1ITGB1ITGA4
SCHEMBL2315949 0.91 MME (0.59) MMEFFAR2MMEL1ITGB1ITGA4
SCHEMBL2315945 0.91 MME (0.59) MMEFFAR2MMEL1ITGB1ITGA4
SCHEMBL2319527 0.88 FFAR2 (0.65) MMEFFAR2MMEL1AVPR1A
SCHEMBL2312748 0.86 FFAR2 (0.51) MMEFFAR2MMEL1ITGB1ITGA4
SCHEMBL2312753 0.86 FFAR2 (0.51) MMEFFAR2MMEL1ITGB1ITGA4
SCHEMBL2315652 0.84 MME (0.54) MMEFFAR2MMEL1ITGB1ITGA4
SCHEMBL2315641 0.84 MME (0.54) MMEFFAR2MMEL1ITGB1ITGA4
SCHEMBL2317684 0.82 MME (0.60) MMEFFAR2MMEL1ITGB1ITGA4
SCHEMBL2317678 0.82 MME (0.60) MMEFFAR2MMEL1ITGB1ITGA4

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
WO-2011092284-A1 NOVEL AMINO ACID DERIVATIVES AND THEIR USE AS GPR43 RECEPTOR MODULATORS EUROSCREEN S.A. (BE) 2011-08-04 WO claimed