SCHEMBL2312936

SCHEMBL2312936

Cc1ccc(CC(=O)N[C@H](CC(=O)O)Cc2ccc(Cl)c(Cl)c2)cc1C

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 1/20 0.51
PSMB8 P28062 2/20 0.49
PSMB5 P28074 2/20 0.49
MMEL1 Q495T6 4/20 0.47
MME P08473 9/20 0.46
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FDFT1 P37268 2/20 0.42
FFAR1 O14842 1/20 0.41

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
SCHEMBL2312945 1.00 FFAR2 (0.51) FFAR2PSMB8PSMB5MMEL1MME
SCHEMBL2320594 0.92 FFAR2 (0.58) FFAR2MMEL1MMELMNAMAPT
SCHEMBL2320587 0.92 FFAR2 (0.58) FFAR2MMEL1MMELMNAMAPT
SCHEMBL2315932 0.88 MME (0.59) FFAR2PSMB8PSMB5MMEL1MME
SCHEMBL2316114 0.88 FFAR2 (0.55) FFAR2PSMB8PSMB5MMEL1MME
SCHEMBL2315940 0.88 MME (0.59) FFAR2PSMB8PSMB5MMEL1MME
SCHEMBL2316107 0.88 FFAR2 (0.55) FFAR2PSMB8PSMB5MMEL1MME
SCHEMBL2315963 0.87 TACR1 (0.50) FFAR2MMEL1MMEFDFT1FFAR1
SCHEMBL2315957 0.87 TACR1 (0.50) FFAR2MMEL1MMEFDFT1FFAR1
SCHEMBL2319372 0.86 FFAR2 (0.57) FFAR2MMEL1MMEMEN1KMT2A

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