SCHEMBL19743928

SCHEMBL19743928

COc1ccc(S(N)(=O)=O)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.50
CA2 P00918 11/20 0.49
CA1 P00915 4/20 0.49
CA9 Q16790 4/20 0.49
CA12 O43570 3/20 0.49
SOS1 Q07889 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
CYP1A1 P04798 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP1B1 Q16678 1/20 0.44
PDIA6 Q15084 1/20 0.44
PKM P14618 1/20 0.43

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
SCHEMBL29503477 1.00 PTGS2 (0.50) PTGS2CA2CA1CA9CA12
SCHEMBL28145710 0.85 CA2 (0.49) PTGS2CA2CA1CA9CA12
SCHEMBL1817484 0.81 TRPV4 (0.47) SMN1; SMN2GAAMAPK1KMT2ACYP1A1
SCHEMBL30540030 0.81 TRPV4 (0.47) SMN1; SMN2GAAMAPK1KMT2ACYP1A1
SCHEMBL27949851 0.81 CYP1A1 (0.47) CA2CA1CA9CA12SMN1; SMN2
SCHEMBL16936936 0.81 CA2 (0.51) PTGS2CA2CA1CA9CA12
SCHEMBL31235134 0.81 CA2 (0.51) PTGS2CA2CA1CA9CA12
SCHEMBL22492257 0.81 SMN1; SMN2 (0.48) SMN1; SMN2GAAMAPK1KMT2ACYP1A1
SCHEMBL24010102 0.80 SMN1; SMN2 (0.47) PTGS2SMN1; SMN2GAAMAPK1KMT2A
Hydrochloric Acid SCHEMBL28128745 0.80 CYP1A1 (0.46) CA2CA1CA9CA12SMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109311894-A N- (substituted-phenyl) -sulfonamide derivatives as kinase inhibitors 内尔维阿诺医学科学有限公司 2019-02-05 CN claimed
EP-3472165-A1 N-(SUBSTITUTED-PHENYL)-SULFONAMIDE DERIVATIVES AS KINASE INHIBITORS Nerviano Medical Sciences S.r.l. (IT) 2019-04-24 EP disclosed
CN-109311894-A N- (substituted-phenyl) -sulfonamide derivatives as kinase inhibitors 内尔维阿诺医学科学有限公司 2019-02-05 CN disclosed
WO-2017220477-A1 N-(SUBSTITUTED-PHENYL)-SULFONAMIDE DERIVATIVES AS KINASE INHIBITORS NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2017-12-28 WO disclosed