SCHEMBL7399288

SCHEMBL7399288

N=C(N)c1ccc2[nH]c(-c3ncccc3O)nc2c1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 14/20 0.55
F2 P00734 12/20 0.55
PLAU P00749 11/20 0.55
PRSS1 P07477 11/20 0.55
PLG P00747 10/20 0.55
PLAT P00750 9/20 0.55
HPN P05981 1/20 0.54
PRSS2 P07478 1/20 0.54
PRSS3 P35030 1/20 0.54
F7 P08709 3/20 0.53
F9 P00740 2/20 0.50
F11 P03951 2/20 0.50

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
SCHEMBL29941452 0.90 F10 (0.69) F10F2PLAUPRSS1PLG
SCHEMBL23793430 0.86 F10 (0.52) F10F2PLAUPRSS1PLG
Hydrochloric Acid SCHEMBL28582597 0.85 F10 (0.51) F10F2PLAUPRSS1PLG
Hydrochloric Acid SCHEMBL30386854 0.85 F10 (0.51) F10F2PLAUPRSS1PLG
SCHEMBL7409967 0.84 F10 (0.60) F10F2PLAUPRSS1PLG
SCHEMBL7403427 0.83 F10 (0.60) F10F2PLAUPRSS1PLG
SCHEMBL6161364 0.81 F10 (0.54) F10F2PLAUPRSS1PLG
SCHEMBL30583190 0.81 F2 (0.81) F10F2PLAUPRSS1PLG
SCHEMBL4992404 0.81 F2 (0.81) F10F2PLAUPRSS1PLG
SCHEMBL6161244 0.80 F2 (0.81) F10F2PLAUPRSS1F7

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-6150379-A BLOOD COAGULATION FACTOR XA INHIBITORS; TREATING DISEASES ASSOCIATED WITH SERINE PROTEASE ACTIVITY; THROMBOLYTIC AND ISCHEMIC AGENTS; E.G., 2-(6-(5-AMIDINO-1H-BENZIMIDAZOL-2-YL)-PYRID-3-YLCARBONYLAMINO)-3 -HYDROXYBUTYRIC ACID AXYS PHARMACEUTICALS, INC. (US) 2000-11-21 US disclosed
WO-1999026941-A1 SUBSTITUTED AMIDINOARYL DERIVATIVES AND THEIR USE AS ANTICOAGULANTS AXYS PHARMACEUTICALS, INC. (US) 1999-06-03 WO disclosed