SCHEMBL7651407

SCHEMBL7651407

CC(C)CNC(=O)c1ccc(-c2ccccc2C(=O)Nc2ccc(C(=N)N)nc2)c(C(=O)OS(C)(=O)=O)c1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F3 P13726 18/20 0.61
F7 P08709 17/20 0.61
F2 P00734 17/20 0.61
F10 P00742 17/20 0.61
PRSS1 P07477 1/20 0.61
PRSS2 P07478 1/20 0.61
PRSS3 P35030 1/20 0.61
PLG P00747 8/20 0.51

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
SCHEMBL7651395 0.90 F3 (0.73) F3F7F2F10PRSS1
SCHEMBL7657514 0.89 F3 (0.77) F3F7F2F10PRSS1
SCHEMBL7661167 0.88 F3 (0.78) F3F7F2F10PRSS1
SCHEMBL7659077 0.87 F3 (0.63) F3F7F2F10PRSS1
SCHEMBL7656089 0.85 F3 (0.63) F3F7F2F10PRSS1
SCHEMBL7656669 0.85 F10 (0.50) F3F7F2F10PRSS1
SCHEMBL7656838 0.83 F2 (0.67) F3F7F2F10PRSS1
SCHEMBL7660183 0.82 F7 (0.60) F3F7F2F10PRSS1
SCHEMBL7661953 0.81 F7 (0.64) F3F7F2F10PRSS1
SCHEMBL7664294 0.81 F3 (0.59) F3F7F2F10PRSS1

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-6358960-B1 FOR THERAPY OF INTRAVASCULAR COAGULATION, CORONARY THROMBOSIS, CEREBRAL INFARCTION, CEREBRAL EMBOLISM, TRANSIENT ISCHEMIC ATTACK, CEREBROVASCULAR DISORDERS, PULMONARY VASCULAR DISEASES, DEEP VENOUS THROMBOSIS, ETC. ONO PHARMACEUTICAL CO., LTD. (JP) 2002-03-19 US disclosed
EP-1078917-A1 AMIDINO DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-02-28 EP disclosed