SCHEMBL2317677

SCHEMBL2317677

Cc1ccc(CC(=O)NC(CC(=O)O)Cc2ccccc2C#N)cc1C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MME P08473 6/20 0.50
PSMB5 P28074 5/20 0.47
PSMB8 P28062 4/20 0.47
FFAR2 O15552 1/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CTSB P07858 2/20 0.41
CTSL P07711 1/20 0.40
CTSS P25774 1/20 0.40
PIN1 Q13526 1/20 0.40
MAOB P27338 1/20 0.40
FFAR1 O14842 1/20 0.39

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
SCHEMBL2317672 1.00 MME (0.50) MMEPSMB5PSMB8FFAR2MEN1
SCHEMBL2314826 0.86 MME (0.49) MMEPSMB5PSMB8PIN1MAOB
SCHEMBL2314822 0.86 MME (0.49) MMEPSMB5PSMB8PIN1MAOB
SCHEMBL2314809 0.83 MME (0.53) MMEPSMB5PSMB8FFAR2CTSB
SCHEMBL2314812 0.83 MME (0.53) MMEPSMB5PSMB8FFAR2CTSB
SCHEMBL2311982 0.79 PSMB8 (0.54) MMEPSMB5PSMB8FFAR2MEN1
SCHEMBL2311985 0.79 PSMB8 (0.54) MMEPSMB5PSMB8FFAR2MEN1
SCHEMBL2316203 0.79 MME (0.52) MMEPSMB5PSMB8FFAR2MEN1
SCHEMBL2316192 0.79 MME (0.52) MMEPSMB5PSMB8FFAR2MEN1
SCHEMBL2317942 0.77 MME (0.56) MMEPSMB5PSMB8FFAR2MEN1

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