SCHEMBL7368274

SCHEMBL7368274

[CH2]Oc1ccc(NS(C)(=O)=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.61
LMNA P02545 3/20 0.56
MAPK1 P28482 2/20 0.56
GAA P10253 1/20 0.56
KIF11 P52732 3/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
KEAP1 Q14145 1/20 0.54
HPGD P15428 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
ALDH1A1 P00352 2/20 0.53
KDM4E B2RXH2 1/20 0.53
HTT P42858 1/20 0.53
AR P10275 1/20 0.53
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
CA12 O43570 1/20 0.52
CA9 Q16790 1/20 0.52
RECQL P46063 1/20 0.46
NR3C2 P08235 2/20 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
SCHEMBL4205144 0.83 PGR (0.85) PGRLMNAMAPK1GAAKIF11
SCHEMBL12054668 0.82 KEAP1 (0.75) PGRLMNAMAPK1GAAKIF11
SCHEMBL171658 0.81 LMNA (0.79) PGRLMNAMAPK1GAAKIF11
SCHEMBL15387008 0.79 PGR (0.61) PGRLMNAMAPK1GAAKIF11
SCHEMBL2451476 0.79 PGR (0.71) PGRLMNAMAPK1GAAKIF11
SCHEMBL3073466 0.79 NPC1 (0.63) PGRLMNAMAPK1GAAKIF11
SCHEMBL7623713 0.78 PGR (0.59) PGRLMNAMAPK1GAAKIF11
SCHEMBL321265 0.78 PGR (0.59) PGRLMNAMAPK1GAAKIF11
SCHEMBL4668688 0.76 LMNA (0.72) PGRLMNAMAPK1GAAKIF11
SCHEMBL3073463 0.76 PGR (0.58) PGRLMNAMAPK1GAAKIF11

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-1994002463-A1 ANTIHYPERTENSIVE 1,4-DIHYDROPYRIDINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-02-03 WO disclosed