SCHEMBL7014403

SCHEMBL7014403

COC(=O)CNC(=O)C1CN(c2ccnc(C)c2)CCN1C(=O)CCS(=O)(=O)c1ccc2cc(Cl)ccc2c1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.56
F2 P00734 1/20 0.56
PLAT P00750 1/20 0.56
KLKB1 P03952 1/20 0.56

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
SCHEMBL7015080 0.91 F10 (0.54) F10F2PLATKLKB1
SCHEMBL7016185 0.90 F10 (0.60) F10F2PLATKLKB1
SCHEMBL7018003 0.90 F10 (0.60) F10F2PLATKLKB1
SCHEMBL7009981 0.87 F10 (0.62) F10F2PLATKLKB1
SCHEMBL7015568 0.87 F10 (0.63) F10F2PLATKLKB1
SCHEMBL7018533 0.86 F10 (0.62) F10F2PLATKLKB1
SCHEMBL7008908 0.85 F10 (0.65) F10F2PLATKLKB1
SCHEMBL7016831 0.83 F10 (0.62) F10F2PLATKLKB1
SCHEMBL7013505 0.83 F10 (0.56) F10F2PLATKLKB1
SCHEMBL7013773 0.82 F10 (0.59) F10F2PLATKLKB1

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-1302462-A1 SULFONE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-04-16 EP disclosed