SCHEMBL7658975

SCHEMBL7658975

CC(C)(C)[C@@H](CO)NC(=O)c1ccc(-c2ccccc2C(=O)Nc2ccc(C(=N)N)cc2)c(C(=O)OS(C)(=O)=O)c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.58
F7 P08709 13/20 0.58
F2 P00734 11/20 0.58
PRSS1 P07477 5/20 0.58
PRSS2 P07478 5/20 0.58
PRSS3 P35030 5/20 0.58
F9 P00740 4/20 0.58
PLAU P00749 3/20 0.58
F11 P03951 2/20 0.58
F3 P13726 10/20 0.53
PLAT P00750 2/20 0.46
PLG P00747 5/20 0.43

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
SCHEMBL7652034 0.92 F7 (0.53) F10F7F2PRSS1PRSS2
SCHEMBL7655252 0.91 F10 (0.51) F10F7F2PRSS1PRSS2
SCHEMBL7656669 0.90 F10 (0.50) F10F7F2PRSS1PRSS2
SCHEMBL7656815 0.90 F7 (0.57) F10F7F2PRSS1PRSS2
SCHEMBL7660672 0.89 F3 (0.56) F10F7F2PRSS1PRSS2
SCHEMBL7658302 0.89 F3 (0.56) F10F7F2PRSS1PRSS2
SCHEMBL7661396 0.89 F3 (0.56) F10F7F2PRSS1PRSS2
SCHEMBL7655527 0.89 F10 (0.62) F10F7F2PRSS1PRSS2
SCHEMBL7658061 0.89 F10 (0.55) F10F7F2PRSS1PRSS2
SCHEMBL7675780 0.88 F7 (0.71) F10F7F2PRSS1PRSS2

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