SCHEMBL7656785

SCHEMBL7656785

CCOC(=O)c1cc(C(=O)NCC(C)C)ccc1-c1ccccc1COc1ccc(C(N)=NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F3 P13726 13/20 0.41
F7 P08709 13/20 0.41
F10 P00742 12/20 0.41
F2 P00734 11/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PLG P00747 5/20 0.39
ADAM17 P78536 1/20 0.36
F11 P03951 1/20 0.36
PTPRC P08575 2/20 0.36
KDM4E B2RXH2 1/20 0.35
KCNA5 P22460 1/20 0.35

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
SCHEMBL7664393 0.88 F3 (0.41) F3F7F10F2PRSS1
SCHEMBL7664289 0.86 F7 (0.55) F3F7F10F2PRSS1
SCHEMBL7658663 0.79 F3 (0.44) F3F7F10F2PRSS1
SCHEMBL7663442 0.79 F3 (0.46) F3F7F10F2PRSS1
SCHEMBL7688990 0.78 F3 (0.63) F3F7F10F2PRSS1
SCHEMBL7656909 0.77 F7 (0.68) F3F7F10F2PRSS1
SCHEMBL7656726 0.76 F3 (0.57) F3F7F10F2PRSS1
SCHEMBL7663557 0.75 F7 (0.54) F3F7F10F2PRSS1
SCHEMBL7651357 0.74 F3 (0.47) F3F7F10F2PRSS1
SCHEMBL7660558 0.74 F3 (0.51) F3F7F10F2PRSS1

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