SCHEMBL2313800

SCHEMBL2313800

N#Cc1ccccc1CC(CC(=O)O)NC(=O)Cc1ccccc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.47
PSMB5 P28074 4/20 0.45
PSMB8 P28062 1/20 0.42
FFAR2 O15552 1/20 0.41
CNR2 P34972 1/20 0.40
SIGMAR1 Q99720 1/20 0.39
POLQ O75417 1/20 0.39
PPARG P37231 2/20 0.37
PPARA Q07869 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
EPHX2 P34913 1/20 0.37
PIN1 Q13526 2/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37

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
SCHEMBL2313795 1.00 MME (0.47) MMEPSMB5PSMB8FFAR2CNR2
SCHEMBL2314822 0.83 MME (0.49) MMEPSMB5PSMB8PIN1
SCHEMBL2314826 0.83 MME (0.49) MMEPSMB5PSMB8PIN1
SCHEMBL2312167 0.80 FFAR2 (0.64) MMEPSMB5FFAR2CNR2PPARG
SCHEMBL2312174 0.80 FFAR2 (0.64) MMEPSMB5FFAR2CNR2PPARG
SCHEMBL2316497 0.79 FFAR2 (0.60) MMEPSMB5PSMB8FFAR2CNR2
SCHEMBL2316507 0.79 FFAR2 (0.60) MMEPSMB5PSMB8FFAR2CNR2
SCHEMBL2318821 0.77 MME (0.44) MMEPSMB5PSMB8ALDH1A1HTT
SCHEMBL2318812 0.77 MME (0.44) MMEPSMB5PSMB8ALDH1A1HTT
SCHEMBL2317677 0.77 MME (0.50) MMEPSMB5PSMB8FFAR2GAA

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