SCHEMBL7654813

SCHEMBL7654813

CNCc1ccc(-c2ccccc2C(=O)Nc2ccc(C(=N)N)cc2)c(C(=O)O)c1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F2 P00734 17/20 0.66
F10 P00742 17/20 0.66
F7 P08709 16/20 0.66
F3 P13726 16/20 0.66
PRSS1 P07477 1/20 0.66
PRSS2 P07478 1/20 0.66
PRSS3 P35030 1/20 0.66
PLG P00747 11/20 0.62
PLAU P00749 3/20 0.55
PLAT P00750 3/20 0.55
KLK1 P06870 1/20 0.50
KLK5 Q9Y337 1/20 0.50

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
SCHEMBL7656911 0.96 F2 (0.62) F2F10F7F3PRSS1
SCHEMBL7681313 0.96 F2 (0.62) F2F10F7F3PRSS1
SCHEMBL7651983 0.92 F2 (0.59) F2F10F7F3PRSS1
SCHEMBL7683549 0.87 F7 (0.69) F2F10F7F3PRSS1
SCHEMBL7663187 0.87 F7 (0.75) F2F10F7F3PRSS1
SCHEMBL7663228 0.85 F2 (0.71) F2F10F7F3PRSS1
SCHEMBL7661321 0.85 F3 (0.74) F2F10F7F3PRSS1
SCHEMBL7657658 0.84 F2 (0.73) F2F10F7F3PRSS1
SCHEMBL7656009 0.84 F7 (0.65) F2F10F7F3PRSS1
SCHEMBL7660407 0.84 F7 (0.70) 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 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