SCHEMBL7660740

SCHEMBL7660740

CCCOc1ccc(-c2ccc(C(=O)N[C@H](COS(C)(=O)=O)C(C)(C)C)cc2C(=O)O)c(C(=O)Nc2ccc(C(=N)N)cc2)n1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F7 P08709 20/20 0.68
F9 P00740 9/20 0.68
F10 P00742 8/20 0.68
F2 P00734 6/20 0.68
PRSS1 P07477 5/20 0.68
PRSS2 P07478 5/20 0.68
PRSS3 P35030 5/20 0.68
F11 P03951 5/20 0.68
PLAU P00749 3/20 0.68
F3 P13726 4/20 0.43
PLG P00747 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
SCHEMBL7654587 0.96 F7 (0.68) F7F9F10F2PRSS1
SCHEMBL7659002 0.95 F7 (0.69) F7F9F10F2PRSS1
SCHEMBL7660730 0.92 F7 (0.78) F7F9F10F2PRSS1
SCHEMBL7657454 0.92 F7 (0.81) F7F9F10F2PRSS1
SCHEMBL7662385 0.91 F7 (0.70) F7F9F10F2PRSS1
SCHEMBL7651283 0.91 F7 (0.83) F7F9F10F2PRSS1
SCHEMBL7651271 0.91 F7 (0.83) F7F9F10F2PRSS1
SCHEMBL7656293 0.89 F7 (0.66) F7F9F10F2PRSS1
SCHEMBL7854539 0.89 F7 (0.53) F7F9F10F2PRSS1
SCHEMBL7654579 0.89 F7 (0.77) F7F9F10F2PRSS1

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 1 patent. 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