SCHEMBL15911534

SCHEMBL15911534

COc1cccc(S(=O)(=O)n2c(OC(=O)NC3CCN(C(C)C)CC3)cc3ccccc32)c1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.59
HTR6 P50406 2/20 0.51
MCHR1 Q99705 3/20 0.45
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.43
DRD4 P21917 1/20 0.41

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
SCHEMBL1675265 0.89 F10 (0.70) F10HTR6
SCHEMBL15911673 0.84 F10 (0.77) F10MCHR1MAPTDRD4
SCHEMBL15911398 0.82 F10 (0.60) F10MCHR1MAPTDRD4
SCHEMBL15911708 0.81 F10 (0.78) F10MCHR1DRD4
SCHEMBL15911445 0.80 F10 (0.69) F10MCHR1DRD4
SCHEMBL15911543 0.79 F10 (0.64) F10MCHR1MAPT
SCHEMBL15911525 0.77 F10 (0.65) F10DRD4
SCHEMBL15911489 0.76 F10 (0.68) F10MCHR1MAPTDRD4
SCHEMBL1675138 0.75 F10 (1.00) F10MCHR1
SCHEMBL15911644 0.74 F10 (0.68) F10MCHR1MAPTDRD4

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
EP-1451185-B1 INDOLE-2-CARBOXAMIDES AS FACTOR XA INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2014-08-06 EP claimed