SCHEMBL1848723

SCHEMBL1848723

CS(=O)(=O)NCCCOc1ccc(-c2sc(C(=O)NC(=O)C3(c4ccccc4)CCNCC3)cc2-c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 2/20 0.36
CNR1 P21554 2/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MCL1 Q07820 2/20 0.33
BCL2L1 Q07817 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PLA2G4A P47712 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HTT P42858 1/20 0.32
EPHX2 P34913 1/20 0.32
CNR2 P34972 1/20 0.32
PRKAB2 O43741 2/20 0.31
PRKAG1 P54619 2/20 0.31
PRKAA2 P54646 2/20 0.31
PRKAA1 Q13131 2/20 0.31
PRKAG3 Q9UGI9 2/20 0.31
PRKAG2 Q9UGJ0 2/20 0.31
PRKAB1 Q9Y478 2/20 0.31

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
SCHEMBL1846542 0.95 EP300 (0.35) EP300CNR1NPC1RAB9AMCL1
SCHEMBL1847877 0.92 EP300 (0.37) EP300NPC1RAB9AMCL1BCL2L1
SCHEMBL1852052 0.89 EP300 (0.39) EP300CNR1MCL1BCL2L1EPHX2
SCHEMBL1849353 0.89 EP300 (0.36) EP300NPC1RAB9AMCL1BCL2L1
SCHEMBL1847919 0.88 EP300 (0.37) EP300CNR1NPC1RAB9AMEN1
SCHEMBL1848299 0.85 EP300 (0.47) EP300CNR1NPC1RAB9ASMN1; SMN2
SCHEMBL1848054 0.85 PRKAB2 (0.38) EP300CNR1MCL1BCL2L1EPHX2
SCHEMBL1848627 0.82 ROCK2 (0.38) EP300CNR1EPHX2CNR2ROCK2
SCHEMBL2158344 0.81 CNR1 (0.46) CNR1CNR2
SCHEMBL1847077 0.81 EP300 (0.36) EP300PRKAB2PRKAG1PRKAA2PRKAA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2324015-A2 THIOPHENE-2-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF Sanofi-aventis (FR) 2011-05-25 EP disclosed
WO-2010012964-A2 THIOPHENE-2-CARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-02-04 WO disclosed