SCHEMBL7653271

SCHEMBL7653271

CC(=O)OC(=O)c1ccccc1-c1ccccc1CCc1ccc(C(=N)N)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
F2 P00734 12/20 0.41
F10 P00742 10/20 0.40
PRSS1 P07477 9/20 0.40
CACNA1B Q00975 1/20 0.39
ST14 Q9Y5Y6 2/20 0.39
PRSS2 P07478 2/20 0.38
PRSS3 P35030 2/20 0.38
PLG P00747 1/20 0.38
C1S P09871 1/20 0.38
PLAU P00749 1/20 0.38
TMPRSS15 P98073 1/20 0.37
TMPRSS6 Q8IU80 1/20 0.37
NQO2 P16083 1/20 0.37

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
Acetic Acid SCHEMBL7653265 0.84 F2 (0.43) KMT2AF2F10PRSS1ST14
SCHEMBL7664428 0.83 F2 (0.47) KMT2AF2F10PRSS1ST14
SCHEMBL7679501 0.70 F7 (0.70) F2F10PRSS1PRSS2PRSS3
SCHEMBL7658493 0.68 F2 (0.52) F2F10PRSS1
SCHEMBL7651340 0.67 F2 (0.44) F2F10PRSS1PRSS2PRSS3
SCHEMBL537039 0.66 ALDH1A1 (0.49)
SCHEMBL7655295 0.65 PLAU (0.58) KMT2AF2F10PRSS1PRSS2
SCHEMBL7666062 0.65 PLAU (0.61) F2F10PRSS1PRSS2PRSS3
SCHEMBL2778 0.65 TSHR (0.52)
SCHEMBL30084385 0.65 TSHR (0.52)

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