SCHEMBL15911461

SCHEMBL15911461

COc1cccc(Cn2c(OC(=O)NC3CCN(C(C)C)CC3)cc3cc(OCc4ccccc4)ccc32)c1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.63
SIGMAR1 Q99720 1/20 0.47
DRD4 P21917 2/20 0.46
PLA2G2A P14555 1/20 0.45
MCHR1 Q99705 2/20 0.43
MAPT P10636 1/20 0.42
CCR2 P41597 1/20 0.42

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
SCHEMBL15911644 0.94 F10 (0.68) F10SIGMAR1DRD4MCHR1MAPT
SCHEMBL1674963 0.89 F10 (0.79) F10DRD4CCR2
SCHEMBL15911708 0.89 F10 (0.78) F10SIGMAR1DRD4MCHR1
SCHEMBL15911647 0.88 F10 (0.65) F10SIGMAR1DRD4MCHR1CCR2
SCHEMBL15911349 0.88 F10 (0.65) F10SIGMAR1DRD4MCHR1MAPT
SCHEMBL15911489 0.87 F10 (0.68) F10SIGMAR1DRD4MCHR1MAPT
SCHEMBL15911630 0.85 F10 (0.63) F10SIGMAR1DRD4PLA2G2AMCHR1
SCHEMBL1675042 0.82 F10 (0.87) F10DRD4CCR2
SCHEMBL15911525 0.82 F10 (0.65) F10SIGMAR1DRD4
SCHEMBL15911445 0.82 F10 (0.69) F10SIGMAR1DRD4MCHR1

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