SCHEMBL2317645

SCHEMBL2317645

O=C(O)CC(Cc1ccc(Cl)cc1)NC(=O)Cc1ccsc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MME P08473 7/20 0.59
FFAR2 O15552 1/20 0.53
MMEL1 Q495T6 4/20 0.49
POLB P06746 1/20 0.48
THRB P10828 1/20 0.47
HPGD P15428 1/20 0.47
PSMB8 P28062 1/20 0.45
PSMB5 P28074 1/20 0.45
CNR2 P34972 2/20 0.44
KMT2A Q03164 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
SCHEMBL2317640 1.00 MME (0.59) MMEFFAR2MMEL1POLBTHRB
SCHEMBL2318159 1.00 MME (0.59) MMEFFAR2MMEL1POLBTHRB
SCHEMBL2317792 0.88 MME (0.47) MMEFFAR2MMEL1HPGDPSMB8
SCHEMBL2317781 0.88 MME (0.47) MMEFFAR2MMEL1HPGDPSMB8
SCHEMBL2316475 0.87 FFAR2 (0.47) MMEFFAR2MMEL1POLB
SCHEMBL2316468 0.87 FFAR2 (0.47) MMEFFAR2MMEL1POLB
SCHEMBL2314959 0.87 MME (0.71) MMEFFAR2MMEL1PSMB8PSMB5
SCHEMBL2314965 0.87 MME (0.71) MMEFFAR2MMEL1PSMB8PSMB5
SCHEMBL2314916 0.86 FFAR2 (0.62) MMEFFAR2MMEL1POLBHPGD
SCHEMBL2314911 0.86 FFAR2 (0.62) MMEFFAR2MMEL1POLBHPGD

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