SCHEMBL2312968

SCHEMBL2312968

O=C(O)CC(Cc1ccc(Cl)cc1)NC(=O)Cc1ccc(Cl)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MME P08473 7/20 0.60
MMEL1 Q495T6 6/20 0.58
FFAR2 O15552 1/20 0.56
ERCC1 P07992 2/20 0.49
ERCC4 Q92889 2/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
GALR3 O60755 1/20 0.45
NR2F2 P24468 1/20 0.45

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
SCHEMBL2312962 1.00 MME (0.60) MMEMMEL1FFAR2ERCC1ERCC4
SCHEMBL2319342 0.90 FFAR2 (0.72) MMEMMEL1FFAR2PRSS1PRSS2
SCHEMBL2319336 0.90 FFAR2 (0.72) MMEMMEL1FFAR2PRSS1PRSS2
SCHEMBL2313157 0.89 FFAR2 (0.62) MMEMMEL1FFAR2ERCC1ERCC4
SCHEMBL2313155 0.89 FFAR2 (0.62) MMEMMEL1FFAR2ERCC1ERCC4
SCHEMBL2312992 0.89 MME (0.51) MMEMMEL1FFAR2ERCC1ERCC4
SCHEMBL2313004 0.89 MME (0.51) MMEMMEL1FFAR2ERCC1ERCC4
SCHEMBL2317678 0.88 MME (0.60) MMEMMEL1FFAR2MEN1KMT2A
SCHEMBL2317684 0.88 MME (0.60) MMEMMEL1FFAR2MEN1KMT2A
SCHEMBL2314959 0.85 MME (0.71) MMEMMEL1FFAR2KMT2A

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