SCHEMBL7707649

SCHEMBL7707649

Cc1c(S(=O)(=O)Cc2ccccc2)c2ccccn2c1CC(=O)N(C)Cc1cccc(Cl)c1

nearest known ligand 0.82

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 6/20 0.82
HCRTR1 O43613 5/20 0.82
LMNA P02545 2/20 0.43
AOC3 Q16853 1/20 0.40
RIPK1 Q13546 1/20 0.39
POLB P06746 1/20 0.38
TSPO P30536 1/20 0.38
MAPT P10636 2/20 0.37
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
TP53 P04637 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.36
LIMK2 P53671 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL7709056 0.94 HCRTR2 (0.82) HCRTR2HCRTR1LMNAAOC3RIPK1
SCHEMBL7707551 0.92 HCRTR2 (0.71) HCRTR2HCRTR1LMNAAOC3RIPK1
SCHEMBL7707423 0.91 HCRTR2 (1.00) HCRTR2HCRTR1POLBTSPOMAPT
SCHEMBL7710901 0.85 HCRTR2 (1.00) HCRTR2HCRTR1LMNATSPOMAPT
SCHEMBL7709453 0.83 HCRTR2 (1.00) HCRTR2HCRTR1LMNAPOLBTSPO
SCHEMBL7701854 0.82 HCRTR2 (0.86) HCRTR2HCRTR1LMNATSPOMAPT
SCHEMBL7708524 0.80 HCRTR2 (0.74) HCRTR2HCRTR1LMNAAOC3RIPK1
SCHEMBL2585096 0.79 HCRTR2 (0.74) HCRTR2HCRTR1POLBMAPTKDM4E
SCHEMBL7710724 0.76 HCRTR2 (0.70) HCRTR2HCRTR1POLBKDM4EALDH1A1
SCHEMBL2584748 0.74 HCRTR2 (0.63) HCRTR2HCRTR1LMNAPOLBTSPO

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-2011138266-A1 INDOLIZINE AND IMIDAZOPYRIDINE DERIVATIVES AS OREXIN RECEPTOR ANTAGONISTS EVOTEC AG (DE) 2011-11-10 WO disclosed