SCHEMBL10977644

SCHEMBL10977644

CCOC=NS(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
F2 P00734 2/20 0.49
PRSS1 P07477 2/20 0.49
PRSS2 P07478 2/20 0.49
PRSS3 P35030 2/20 0.49
PKM P14618 6/20 0.47
GAA P10253 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PTGS2 P35354 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
MMP13 P45452 3/20 0.41
MMP8 P22894 2/20 0.41
MMP1 P03956 2/20 0.41

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
SCHEMBL10682761 0.83 LMNA (0.53) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL10683204 0.82 KMT2A (0.44) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL10681241 0.82 CA2 (0.46) ALDH1A1F2GAAMEN1KMT2A
SCHEMBL10671764 0.82 F2 (0.44) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL1178745 0.76 ALDH1A1 (0.52) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL19547285 0.75 ALDH1A1 (0.88) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL19547283 0.75 ALDH1A1 (0.88) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL7310589 0.74 F2 (0.56) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL3030385 0.74 ALDH1A1 (0.50) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL3030388 0.74 ALDH1A1 (0.50) ALDH1A1F2PRSS1PRSS2PRSS3

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-0159012-A2 Sulfonamidines, a process for preparing them and pharmaceutical compositions containing them FERRER INTERNACIONAL, S.A. (ES) 1985-10-23 EP disclosed