SCHEMBL2312665

SCHEMBL2312665

O=C(O)C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC(=O)Cc1ccc(C(F)(F)F)cc1

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 9/20 0.74
MME P08473 5/20 0.58
CNR2 P34972 2/20 0.56
PTPN1 P18031 2/20 0.49
PTPN2 P17706 1/20 0.49
PTPRA P18433 1/20 0.49
PTPN6 P29350 1/20 0.49
PTPN11 Q06124 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
PIN1 Q13526 1/20 0.48

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
SCHEMBL2312671 1.00 FFAR2 (0.74) FFAR2MMECNR2PTPN1PTPN2
SCHEMBL2316365 1.00 FFAR2 (0.74) FFAR2MMECNR2PTPN1PTPN2
SCHEMBL2364855 0.96 FFAR2 (0.77) FFAR2MMECNR2PIN1
SCHEMBL2364853 0.96 FFAR2 (0.77) FFAR2MMECNR2PIN1
SCHEMBL2317502 0.94 FFAR2 (0.67) FFAR2MMECNR2PTPN1PTPN2
SCHEMBL2314845 0.94 FFAR2 (0.78) FFAR2MMECNR2
SCHEMBL2319964 0.94 FFAR2 (0.78) FFAR2MMECNR2
SCHEMBL2317510 0.94 FFAR2 (0.67) FFAR2MMECNR2PTPN1PTPN2
SCHEMBL2314839 0.94 FFAR2 (0.78) FFAR2MMECNR2
SCHEMBL2316453 0.92 FFAR2 (0.65) FFAR2MMECNR2

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