SCHEMBL7656288

SCHEMBL7656288

CCOC(=O)c1cc(C(=O)NCC(C)C)ccc1-c1ccccc1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F3 P13726 14/20 0.61
F7 P08709 13/20 0.61
F10 P00742 13/20 0.61
F2 P00734 12/20 0.61
PRSS1 P07477 2/20 0.61
PRSS2 P07478 2/20 0.61
PRSS3 P35030 2/20 0.61
PLG P00747 6/20 0.51
GAA P10253 1/20 0.48
KMT2A Q03164 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CA12 O43570 1/20 0.48
CA4 P22748 1/20 0.48
CA7 P43166 1/20 0.48
KDM4E B2RXH2 1/20 0.48
F11 P03951 1/20 0.47

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
SCHEMBL7652022 0.86 F3 (0.48) F3F7F10F2PRSS1
SCHEMBL7656638 0.80 F3 (0.74) F3F7F10F2PRSS1
SCHEMBL7688990 0.80 F3 (0.63) F3F7F10F2PRSS1
SCHEMBL7664289 0.79 F7 (0.55) F3F7F10F2PRSS1
SCHEMBL7663714 0.78 F10 (0.54) F3F7F10F2PRSS1
SCHEMBL7657918 0.76 F7 (0.56) F3F7F10F2PRSS1
SCHEMBL5572323 0.76 TSHR (0.69) KMT2AHSD17B10KDM4E
SCHEMBL7656938 0.76 F3 (1.00) F3F7F10F2PRSS1
SCHEMBL7665736 0.76 F3 (0.51) F3F7F10F2PRSS1
SCHEMBL8485581 0.75 GAA (0.59) F3F7F10F2PRSS1

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