SCHEMBL7365576

SCHEMBL7365576

N=C(N)c1ccc2c(ccn2CC(=O)N2CCC(Cc3cccc(F)c3)CC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F2 P00734 10/20 1.00
PRSS1 P07477 4/20 0.55
PLAU P00749 5/20 0.48
PLG P00747 3/20 0.48
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
F10 P00742 1/20 0.43

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
SCHEMBL7365097 0.90 F2 (1.00) F2PRSS1PLAUPLGF10
SCHEMBL7360119 0.85 F2 (0.75) F2PLAUPLG
SCHEMBL7363988 0.85 F2 (1.00) F2PRSS1PLAUPLGMAPT
SCHEMBL7362115 0.81 F2 (0.82) F2PRSS1PLAUPLGF10
SCHEMBL7364712 0.78 F2 (0.64) F2PRSS1PLAUTP53F10
SCHEMBL7366569 0.78 F2 (0.74) F2PRSS1PLAUPLGF10
SCHEMBL27943803 0.73 F2 (0.56) F2
SCHEMBL7367913 0.73 F2 (1.00) F2PRSS1F10
SCHEMBL7362114 0.73 F2 (0.69) F2PRSS1F10
SCHEMBL7359608 0.72 F2 (0.68) F2PRSS1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0960102-A1 AMIDINOINDOLES, AMIDINOAZOLES, AND ANALOGS THEREOF AS INHIBITORS OF FACTOR Xa AND OF THROMBIN Du Pont Pharmaceuticals Company (US) 1999-12-01 EP claimed
WO-1998001428-A1 AMIDINOINDOLES, AMIDINOAZOLES, AND ANALOGS THEREOF AS INHIBITORS OF FACTOR Xa AND OF THROMBIN DU PONT PHARMACEUTICALS COMPANY (US) 1998-01-15 WO claimed
US-6043257-A ANTICOAGULANT; PYRIDINE SUBSTITUTED INDAZOLE COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-03-28 US disclosed
US-5886191-A ANTICOAGULANTS DUPONT PHARMACEUTICALS COMPANY (US) 1999-03-23 US disclosed