SCHEMBL7656056

SCHEMBL7656056

CC(C)CN(C)C(=O)c1ccc(-c2ccccc2C(=O)Nc2ccc(C(=N)N)cc2)c(C(=O)OS(C)(=O)=O)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F2 P00734 17/20 0.56
F10 P00742 17/20 0.56
F7 P08709 16/20 0.56
F3 P13726 16/20 0.56
PRSS1 P07477 1/20 0.56
PRSS2 P07478 1/20 0.56
PRSS3 P35030 1/20 0.56
PLG P00747 10/20 0.46
PLAU P00749 2/20 0.44
PLAT P00750 2/20 0.44
KLK1 P06870 1/20 0.42
KLK5 Q9Y337 1/20 0.42

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
SCHEMBL7656045 0.90 F3 (0.67) F2F10F7F3PRSS1
SCHEMBL7662262 0.89 F10 (0.52) F2F10F7F3PRSS1
SCHEMBL7660441 0.88 F3 (0.72) F2F10F7F3PRSS1
SCHEMBL7856195 0.86 F2 (0.57) F2F10F7F3PRSS1
SCHEMBL7665027 0.86 F10 (0.49) F2F10F7F3PRSS1
SCHEMBL7653604 0.86 F7 (0.57) F2F10F7F3PRSS1
SCHEMBL7666086 0.85 F3 (0.64) F2F10F7F3PRSS1
SCHEMBL7657514 0.85 F3 (0.77) F2F10F7F3PRSS1
SCHEMBL7665050 0.85 F3 (0.59) F2F10F7F3PRSS1
SCHEMBL7661392 0.83 F10 (0.56) F2F10F7F3PRSS1

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