SCHEMBL8002425

SCHEMBL8002425

COc1cc(Cl)cc(C(=O)Nc2ccc(Cl)cn2)c1NC(=O)c1scc(CNC(=N)N(C)O)c1Cl

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 19/20 0.77
F10 P00742 18/20 0.77
KLKB1 P03952 1/20 0.77
ELANE P08246 1/20 0.77

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
SCHEMBL6596203 0.93 F2 (0.77) F2F10KLKB1ELANE
SCHEMBL6591235 0.88 F2 (0.86) F2F10KLKB1ELANE
SCHEMBL6597007 0.88 F2 (0.81) F2F10KLKB1ELANE
SCHEMBL6590418 0.88 F2 (0.77) F2F10KLKB1ELANE
SCHEMBL6589466 0.87 F2 (0.74) F2F10KLKB1ELANE
SCHEMBL6589576 0.87 F2 (1.00) F2F10KLKB1ELANE
SCHEMBL6593581 0.87 F2 (0.76) F2F10KLKB1ELANE
SCHEMBL6589069 0.87 F2 (0.76) F2F10KLKB1ELANE
SCHEMBL6589654 0.86 F2 (0.75) F2F10KLKB1ELANE
SCHEMBL6590183 0.86 F2 (0.86) F2F10KLKB1ELANE

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
US-6140351-A FOR TREATING THROMBOSIS BERLEX LABORATORIES, INC. (US) 2000-10-31 US disclosed