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SCHEMBL8540710

SCHEMBL8540710

COc1cc(OC)nc(N(C(N)=O)S(=O)(=O)Nn2cccc2C(=O)C(F)(F)F)n1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ TP53 P04637 1/20 0.31
▸ GLA P06280 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ GAA P10253 1/20 0.30
▸ TSHR P16473 1/20 0.30

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
SCHEMBL8539506 0.83 SMN1; SMN2 (0.32) SMN1; SMN2TP53GLAMAPT
SCHEMBL9247051 0.78 SMN1; SMN2 (0.35) SMN1; SMN2TP53GLAMAPTGAA
SCHEMBL8829538 0.75 GAA (0.48) SMN1; SMN2TP53GLAMAPTGAA
SCHEMBL28716152 0.66 SMN1; SMN2 (0.38) SMN1; SMN2TP53GLAMAPTTSHR
SCHEMBL1535842 0.64 SMN1; SMN2 (0.35) SMN1; SMN2TP53GLAMAPTGAA
SCHEMBL29992711 0.64 SMN1; SMN2 (0.35) SMN1; SMN2TP53GLAMAPTGAA
SCHEMBL4016263 0.64 TUBB4A (0.43) SMN1; SMN2MAPTGAATSHR
SCHEMBL1535820 0.63 TUBB4A (0.42) SMN1; SMN2MAPTGAATSHR
SCHEMBL8733579 0.63 SMN1; SMN2 (0.41) SMN1; SMN2MAPTGAA
SCHEMBL8544311 0.62 CDK1 (0.48) SMN1; SMN2TP53GLAMAPTGAA

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-0648764-B1 N-(substituted amino)pyrrole derivatives, preparation process thereof, and herbicidal compositions KUREHA CHEMICAL IND CO LTD (JP) 1998-12-16 — — EP disclosed