SCHEMBL9805301

SCHEMBL9805301

Cc1ccc(S(=O)(=O)C(=N)N)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.54
CA2 P00918 3/20 0.54
CA12 O43570 2/20 0.54
CA9 Q16790 2/20 0.54
CA3 P07451 1/20 0.54
CA6 P23280 1/20 0.54
CA5A P35218 1/20 0.54
CA7 P43166 1/20 0.54
CA5B Q9Y2D0 1/20 0.54
F2 P00734 3/20 0.53
PRSS1 P07477 3/20 0.53
PRSS2 P07478 3/20 0.53
PRSS3 P35030 3/20 0.53
GAA P10253 2/20 0.52
ALDH1A1 P00352 6/20 0.52
LMNA P02545 3/20 0.50
MAPT P10636 2/20 0.50
MMP1 P03956 1/20 0.48
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48

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
SCHEMBL12834934 0.84 GAA (0.54) CA1CA2CA12CA9CA3
SCHEMBL179723 0.82 ALDH1A1 (0.57) CA1CA2CA12CA9CA3
Guanidine SCHEMBL811270 0.80 CYP2D6 (0.61) CA1CA2CA12CA9CA3
SCHEMBL9878066 0.78 CYP2D6 (0.55) CA1CA2CA12CA9CA3
SCHEMBL9029471 0.78 HPN (0.50) F2PRSS1PRSS2PRSS3ALDH1A1
SCHEMBL1334815 0.77 GAA (0.52) CA1CA2CA12CA9CA3
SCHEMBL19632642 0.77 GAA (0.46) CA1CA2CA12CA9CA3
Thiourea SCHEMBL1577311 0.77 CYP2D6 (0.58) CA1CA2CA12CA9CA3
SCHEMBL27294672 0.76 SMN1; SMN2 (0.50) CA1CA2CA12CA9CA3
SCHEMBL27914208 0.76 GAA (0.56) CA1CA2CA12CA9CA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0203509-B1 Method for the quantitative determination of protein-C and an activating preparation for its implementation. Pentapharm A.G. (CH) 1991-04-03 EP claimed
US-4849403-A CONVERSION OF ZYMOGEN INTO PROTEINASE; SNAKE VENOM PENTAPHARM AG (CH) 1989-07-18 US claimed
US-4849403-A CONVERSION OF ZYMOGEN INTO PROTEINASE; SNAKE VENOM PENTAPHARM AG (CH) 1989-07-18 US disclosed