SCHEMBL7656624

SCHEMBL7656624

CC(C)[C@H](NC(=O)c1ccc(-c2cccnc2C(=O)Nc2ccc(C(=N)N)cc2)c(C(=O)OCc2ccccc2)c1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F7 P08709 16/20 0.47
F2 P00734 15/20 0.47
F10 P00742 14/20 0.47
PRSS1 P07477 3/20 0.47
PRSS2 P07478 3/20 0.47
PRSS3 P35030 3/20 0.47
F9 P00740 2/20 0.47
PLAU P00749 2/20 0.47
F11 P03951 2/20 0.47
F3 P13726 13/20 0.47
PLG P00747 5/20 0.45
GPR132 Q9UNW8 2/20 0.42
LNPEP Q9UIQ6 1/20 0.41
MAPT P10636 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL7656616 1.00 F7 (0.47) F7F2F10PRSS1PRSS2
SCHEMBL7651999 0.91 F7 (0.51) F7F2F10PRSS1PRSS2
SCHEMBL7659236 0.90 F7 (0.50) F7F2F10PRSS1PRSS2
SCHEMBL7659229 0.90 F7 (0.50) F7F2F10PRSS1PRSS2
SCHEMBL7660781 0.88 F7 (0.55) F7F2F10PRSS1PRSS2
SCHEMBL7660792 0.88 F7 (0.55) F7F2F10PRSS1PRSS2
SCHEMBL7653754 0.88 F7 (0.63) F7F2F10PRSS1PRSS2
SCHEMBL7660872 0.86 F10 (0.47) F7F2F10PRSS1PRSS2
SCHEMBL7660863 0.85 F7 (0.52) F7F2F10PRSS1PRSS2
SCHEMBL7660150 0.85 F3 (0.58) F7F2F10PRSS1PRSS2

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