SCHEMBL7652018

SCHEMBL7652018

Cc1ccc(-c2ccc(C(=O)NCC(C)(C)CCO)cc2C(=O)O)c(C(=O)Nc2ccc(C(=N)N)cc2)n1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F7 P08709 20/20 0.67
F10 P00742 15/20 0.67
F2 P00734 14/20 0.67
PRSS1 P07477 4/20 0.67
PRSS2 P07478 4/20 0.67
PRSS3 P35030 4/20 0.67
F9 P00740 4/20 0.67
F11 P03951 4/20 0.67
PLAU P00749 3/20 0.67
F3 P13726 14/20 0.51
PLG P00747 4/20 0.51

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
SCHEMBL7659061 0.97 F7 (0.64) F7F10F2PRSS1PRSS2
SCHEMBL7655206 0.91 F7 (0.81) F7F10F2PRSS1PRSS2
Hydrochloric Acid SCHEMBL7685432 0.90 F7 (0.79) F7F10F2PRSS1PRSS2
SCHEMBL7659087 0.89 F7 (0.56) F7F10F2PRSS1PRSS2
SCHEMBL7659074 0.89 F7 (0.64) F7F10F2PRSS1PRSS2
SCHEMBL7664258 0.89 F7 (0.56) F7F10F2PRSS1PRSS2
SCHEMBL7663342 0.87 F7 (0.76) F7F10F2PRSS1PRSS2
SCHEMBL7661292 0.84 F7 (0.61) F7F10F2PRSS1PRSS2
SCHEMBL7665941 0.84 F7 (0.72) F7F10F2PRSS1PRSS2
SCHEMBL7653724 0.83 F10 (0.61) F7F10F2PRSS1PRSS2

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