SCHEMBL19576905

SCHEMBL19576905

NNc1ccc(NC(=O)Cc2ccccc2F)cc1S(N)(=O)=O

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 11/20 0.60
▸ NPC1 O15118 3/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ CA1 P00915 3/20 0.50
▸ CA2 P00918 3/20 0.50
▸ CA12 O43570 2/20 0.50
▸ CA9 Q16790 2/20 0.50
▸ LMNA P02545 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ CASP3 P42574 1/20 0.48
▸ SENP7 Q9BQF6 1/20 0.48
▸ ANO1 Q5XXA6 1/20 0.47
▸ GAA P10253 1/20 0.46

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
SCHEMBL22894338 0.86 P2RX4 (0.68) P2RX4LMNAALDH1A1
SCHEMBL24766678 0.86 P2RX4 (0.62) P2RX4NPC1RAB9ACA1CA2
SCHEMBL29716996 0.78 P2RX4 (0.54) P2RX4NPC1RAB9ACA1CA2
SCHEMBL19551955 0.78 P2RX4 (0.54) P2RX4NPC1RAB9ACA1CA2
SCHEMBL19551956 0.78 P2RX4 (0.55) P2RX4NPC1RAB9ALMNASMN1; SMN2
SCHEMBL29716926 0.78 P2RX4 (0.55) P2RX4NPC1RAB9ALMNASMN1; SMN2
SCHEMBL19551916 0.77 P2RX4 (0.53) P2RX4NPC1RAB9ACA1CA2
SCHEMBL20240948 0.77 P2RX4 (0.53) P2RX4NPC1RAB9ACA1CA2
SCHEMBL18301859 0.77 P2RX4 (0.82) P2RX4
SCHEMBL31290144 0.77 P2RX4 (0.82) P2RX4

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
WO-2017191000-A1 AROMATIC SULFONAMIDE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-11-09 — — WO disclosed
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