SCHEMBL9681963

SCHEMBL9681963

COc1nc(OC)nc(Oc2cccc(Cl)c2C(=O)NS(C)(=O)=O)n1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 11/20 0.45
ITGB1 P05556 1/20 0.40
ITGA4 P13612 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL9682580 0.80 CA12 (0.49) NPSR1
SCHEMBL9683758 0.78 NPSR1 (0.50) NPSR1
SCHEMBL9567412 0.75 NPSR1 (0.44) NPSR1
SCHEMBL9682714 0.73 ALDH1A1 (0.47) NPSR1
SCHEMBL9682835 0.71 KMT2A (0.43) ITGB1ITGA4NPSR1
SCHEMBL9045943 0.71 NPSR1 (0.62) NPSR1
SCHEMBL9683847 0.71 MAPT (0.41) SCN9A
SCHEMBL9681993 0.71 SCN9A (0.39) SCN9A
SCHEMBL9622844 0.70 NPSR1 (0.58) NPSR1
SCHEMBL9622225 0.70 NPSR1 (0.58) NPSR1

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
US-5149357-A Herbicidal substituted benzoylsulfonamides FMC CORPORATION (US) 1992-09-22 US disclosed