SCHEMBL6790665

SCHEMBL6790665

CC(=O)OC1CCc2nc(C(=O)N3CCN(S(=O)(=O)c4cc5cc(Cl)ccc5[nH]4)CC3)sc2C1.COC1CCc2nc(C(=O)N3CCN(S(=O)(=O)c4cc5cc(Cl)ccc5[nH]4)CC3)sc2C1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.49
F2 P00734 4/20 0.49
KLK1 P06870 1/20 0.47

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
SCHEMBL6737595 0.97 F10 (0.52) F10F2KLK1
SCHEMBL6725366 0.96 F10 (0.53) F10F2KLK1
SCHEMBL6731180 0.86 F10 (0.40) F10F2KLK1
SCHEMBL6734954 0.85 F10 (0.53) F10F2KLK1
SCHEMBL6729638 0.85 F10 (0.53) F10F2KLK1
SCHEMBL6732756 0.84 F10 (0.41) F10F2KLK1
SCHEMBL6737230 0.84 F10 (0.55) F10F2KLK1
SCHEMBL6734191 0.83 F10 (0.53) F10F2KLK1
SCHEMBL6729856 0.81 F10 (0.49) F10F2KLK1
SCHEMBL6728456 0.79 F10 (0.55) F10F2KLK1

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-6747023-B1 INHIBITORS FOR ACTIVATED COAGULATION FACTOR X, COAGULATION SUPPRESSORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-08 US disclosed
EP-1104754-A1 NOVEL SULFONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-06-06 EP disclosed