SCHEMBL2318052

SCHEMBL2318052

N#Cc1ccc(C[C@@H](CC(=O)O)NC(=O)Cc2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MME P08473 11/20 0.53
▸ FFAR2 O15552 1/20 0.53
▸ MMEL1 Q495T6 3/20 0.49
▸ PIN1 Q13526 1/20 0.44
▸ CNR1 P21554 1/20 0.42
▸ MAOB P27338 1/20 0.41
▸ S1PR1 P21453 2/20 0.41
▸ S1PR3 Q99500 2/20 0.41
▸ RORC P51449 1/20 0.41
▸ ACACB O00763 1/20 0.40

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
SCHEMBL2318057 1.00 MME (0.53) MMEFFAR2MMEL1PIN1CNR1
SCHEMBL2313579 0.89 PIN1 (0.58) MMEFFAR2MMEL1PIN1CNR1
SCHEMBL2313586 0.89 PIN1 (0.58) MMEFFAR2MMEL1PIN1CNR1
SCHEMBL2320594 0.88 FFAR2 (0.58) MMEFFAR2MMEL1S1PR3
SCHEMBL2320587 0.88 FFAR2 (0.58) MMEFFAR2MMEL1S1PR3
SCHEMBL2312944 0.87 MME (0.62) MMEFFAR2MMEL1
SCHEMBL2312952 0.87 MME (0.62) MMEFFAR2MMEL1
SCHEMBL2313373 0.87 FFAR2 (0.70) MMEFFAR2MMEL1PIN1CNR1
SCHEMBL2317794 0.87 FFAR2 (0.70) MMEFFAR2MMEL1PIN1CNR1
SCHEMBL2313378 0.87 FFAR2 (0.70) MMEFFAR2MMEL1PIN1CNR1

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
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