SCHEMBL11385674

SCHEMBL11385674

CC1Cc2ccccc2N1C(=O)c1ccc(Cl)c(NS(=O)(=O)O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.61
MCL1 Q07820 1/20 0.56
SPR P35270 1/20 0.53
PKM P14618 2/20 0.52
ALDH1A1 P00352 6/20 0.52
SMN1; SMN2 Q16637 6/20 0.52
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA3 P07451 1/20 0.52
GAA P10253 1/20 0.52
CA4 P22748 1/20 0.52
CA6 P23280 1/20 0.52
CA5A P35218 1/20 0.52
PTGS2 P35354 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA13 Q8N1Q1 1/20 0.52
CA14 Q9ULX7 1/20 0.52
CA5B Q9Y2D0 1/20 0.52

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
SCHEMBL27181104 0.77 LMNA (0.67) SLC22A12MCL1SPRALDH1A1SMN1; SMN2
SCHEMBL4901588 0.77 SLC22A12 (1.00) SLC22A12MCL1SPRPKMALDH1A1
SCHEMBL27181096 0.73 LMNA (0.61) SLC22A12MCL1PKMALDH1A1SMN1; SMN2
SCHEMBL27179720 0.73 LMNA (0.59) SLC22A12MCL1PKMALDH1A1SMN1; SMN2
SCHEMBL27179533 0.73 LMNA (0.67) SLC22A12MCL1PKMALDH1A1SMN1; SMN2
SCHEMBL27181255 0.72 ALDH1A1 (0.63) SLC22A12MCL1PKMALDH1A1SMN1; SMN2
SCHEMBL27180917 0.71 LMNA (0.58) MCL1PKMALDH1A1SMN1; SMN2LMNA
SCHEMBL30926608 0.71 SLC22A12 (0.52) SLC22A12MCL1SPRPKMALDH1A1
SCHEMBL27180851 0.71 SLC22A12 (0.52) SLC22A12MCL1SPRPKMALDH1A1
SCHEMBL27180152 0.70 MCL1 (0.64) MCL1PKMALDH1A1SMN1; 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-4283407-A ANTIHYPERTENSIVE AGENTS SCIENCE UNION ET CIE (FR) 1981-08-11 US disclosed