SCHEMBL2319095

SCHEMBL2319095

Cc1cccc(CC(=O)N[C@H](CC(=O)O)Cc2cccc(Cl)c2)c1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 3/20 0.68
MMEL1 Q495T6 9/20 0.54
MME P08473 6/20 0.54
CTSV O60911 1/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47
CTSS P25774 1/20 0.47
CTSK P43235 1/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CSNK1D P48730 1/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL2319102 1.00 FFAR2 (0.68) FFAR2MMEL1MMECTSVCTSL
SCHEMBL2313265 0.93 FFAR2 (0.77) FFAR2MMEL1MMEMEN1KMT2A
SCHEMBL2313273 0.93 FFAR2 (0.77) FFAR2MMEL1MMEMEN1KMT2A
SCHEMBL2314864 0.91 FFAR2 (0.65) FFAR2MMEL1MMEALDH1A1
SCHEMBL2312043 0.91 FFAR2 (0.65) FFAR2MMEL1MMEALDH1A1
SCHEMBL2312039 0.91 FFAR2 (0.65) FFAR2MMEL1MMEALDH1A1
SCHEMBL2315526 0.91 FFAR2 (0.74) FFAR2MMEL1MME
SCHEMBL2315533 0.91 FFAR2 (0.74) FFAR2MMEL1MME
SCHEMBL2319372 0.89 FFAR2 (0.57) FFAR2MMEL1MMECTSBMEN1
SCHEMBL2319379 0.89 FFAR2 (0.57) FFAR2MMEL1MMECTSBMEN1

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