SCHEMBL7659557

SCHEMBL7659557

COc1ccc(-c2cc(C)c(C(=O)NCC(C)(C)C)cc2C(=O)O)c(C(=O)Nc2ccc(C(=N)N)cc2)n1

nearest known ligand 0.83

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F7 P08709 19/20 0.83
F9 P00740 9/20 0.83
F11 P03951 5/20 0.83
F10 P00742 5/20 0.83
PRSS1 P07477 4/20 0.83
PRSS2 P07478 4/20 0.83
PRSS3 P35030 4/20 0.83
PLAU P00749 3/20 0.83
F2 P00734 3/20 0.83
PLG P00747 1/20 0.46
F3 P13726 1/20 0.46
KLKB1 P03952 1/20 0.45

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
SCHEMBL7661600 0.97 F7 (0.78) F7F9F11F10PRSS1
SCHEMBL7658735 0.91 F7 (1.00) F7F9F11F10PRSS1
SCHEMBL7661610 0.90 F7 (0.67) F7F9F11F10PRSS1
SCHEMBL7654687 0.89 F7 (0.67) F7F9F11F10PRSS1
SCHEMBL7660145 0.88 F7 (0.93) F7F9F11F10PRSS1
SCHEMBL7662622 0.86 F7 (0.84) F7F9F11F10PRSS1
SCHEMBL7662616 0.86 F7 (0.84) F7F9F11F10PRSS1
SCHEMBL7657424 0.84 F7 (0.87) F7F9F11F10PRSS1
SCHEMBL7852905 0.84 F7 (0.87) F7F9F11F10PRSS1
SCHEMBL7652282 0.84 F7 (0.87) F7F9F11F10PRSS1

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 claimed
EP-1078917-A1 AMIDINO DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2001-02-28 EP claimed