SCHEMBL7289016

SCHEMBL7289016

C/C(N)=C/C(=O)CS(=O)(=O)N(C)C

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.30
PRSS1 P07477 1/20 0.30
PRSS2 P07478 1/20 0.30
PRSS3 P35030 1/20 0.30

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
SCHEMBL7289022 1.00 F2 (0.30) F2PRSS1PRSS2PRSS3
SCHEMBL7288780 0.83
SCHEMBL7282774 0.79
SCHEMBL7282769 0.79
SCHEMBL3466455 0.73 ALDH1A1 (0.38) F2PRSS1PRSS2PRSS3
SCHEMBL7282278 0.73 MMP3 (0.50)
SCHEMBL7282283 0.73 MMP3 (0.50)
SCHEMBL7279289 0.72
SCHEMBL7279285 0.72
Hydrochloric Acid SCHEMBL5498553 0.72 ALDH1A1 (0.36) F2PRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4742069-A CALCIUM ANTAGONIST, ANTIANGINA, ANTIISCHEMIC, HYPOTENSIVE HOFFMANN-LA ROCHE INC. (US) 1988-05-03 US disclosed
EP-0166422-A1 Dihydropyridine derivatives, processes and intermediates for their preparation and pharmaceutical preparations containing them F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1986-01-02 EP disclosed