SCHEMBL6604415

SCHEMBL6604415

CCC(=O)Nc1c(-c2cccc(F)c2)cccc1S(=O)(=O)NC(CCCc1ccc(N)cn1)C(=O)N1CCC(=C(F)F)CC1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 7/20 0.77
F10 P00742 5/20 0.65
POLB P06746 1/20 0.33
TMPRSS6 Q8IU80 1/20 0.33
ST14 Q9Y5Y6 1/20 0.33

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
Hydrochloric Acid SCHEMBL6543195 1.00 F2 (0.77) F2F10POLBTMPRSS6ST14
Hydrochloric Acid SCHEMBL6543191 1.00 F2 (0.77) F2F10POLBTMPRSS6ST14
SCHEMBL6543343 1.00 F2 (0.77) F2F10POLBTMPRSS6ST14
SCHEMBL6543512 0.94 F2 (0.87) F2F10POLB
SCHEMBL6543495 0.94 F2 (0.87) F2F10POLB
SCHEMBL6543301 0.89 F2 (0.60) F2F10ST14
SCHEMBL6543271 0.87 F2 (1.00) F2F10POLB
Hydrochloric Acid SCHEMBL6544370 0.87 F2 (1.00) F2F10POLB
SCHEMBL8028409 0.87 F2 (1.00) F2F10POLB
Hydrochloric Acid SCHEMBL29456385 0.87 F2 (1.00) F2F10POLB

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-1268469-B1 N-(HETEROCYCLYL)BENZENE OR PYRIDINE SULPHONAMIDES AS ANTITHROMBOTIC AGENTS AND ANTICOAGULANTS SANOFI SYNTHELABO (FR) 2004-06-16 EP disclosed