SCHEMBL10876985

SCHEMBL10876985

COc1cc(OC)nc(N(C)C(=O)NS(=O)(=O)c2ccccc2SC(F)F)n1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 1/20 0.36
CDK1 P06493 1/20 0.35
EDNRB P24530 1/20 0.35
EDNRA P25101 1/20 0.35
TP53 P04637 1/20 0.34
GLA P06280 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL10880864 0.94 SMN1; SMN2 (0.46) SMN1; SMN2GAAEDNRBEDNRAMAPT
SCHEMBL10876993 0.88 MEN1 (0.36) GAA
SCHEMBL10880969 0.85 TSHR (0.35) SMN1; SMN2
SCHEMBL9342205 0.82 GAA (0.39) SMN1; SMN2GAACDK1TP53GLA
SCHEMBL10749994 0.81 SMN1; SMN2 (0.42) SMN1; SMN2GAACDK1TP53GLA
SCHEMBL10505654 0.80 SMN1; SMN2 (0.44) SMN1; SMN2GAACDK1TP53GLA
SCHEMBL10505840 0.79 CA1 (0.45) SMN1; SMN2CDK1TP53GLAMAPT
SCHEMBL10504916 0.79 KMT2A (0.51) SMN1; SMN2GAACDK1MAPT
SCHEMBL10460115 0.79 GAA (0.48) GAACDK1TP53GLAMAPT
SCHEMBL10688266 0.78 ALPL (0.44) SMN1; SMN2GAA

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-H168-H Herbicidal sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-12-02 US disclosed