SCHEMBL7090192

SCHEMBL7090192

O=C(O)c1ccc(COc2ccc([N+](=O)[O-])cc2CNc2cc(C(F)(F)F)c(N3CCN(c4cccc(C(F)(F)F)c4)CC3)cc2Oc2ccc(-c3ccncc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SERPINE1 P05121 20/20 0.55

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
SCHEMBL7089096 0.88 SERPINE1 (0.62) SERPINE1
SCHEMBL7163081 0.87 SERPINE1 (0.54) SERPINE1
SCHEMBL7090422 0.83 SERPINE1 (0.73) SERPINE1
SCHEMBL7088271 0.83 SERPINE1 (0.73) SERPINE1
SCHEMBL7084122 0.79 SERPINE1 (0.53) SERPINE1
SCHEMBL7087862 0.77 SERPINE1 (0.58) SERPINE1
SCHEMBL7087931 0.77 SERPINE1 (0.52) SERPINE1
SCHEMBL7085804 0.76 SERPINE1 (0.88) SERPINE1
SCHEMBL7087883 0.74 SERPINE1 (0.69) SERPINE1
SCHEMBL7085685 0.72 SERPINE1 (1.00) SERPINE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003080060-A1 SUBSTITUTED PIPERAZINE ANTITHROMBOTIC PAI-1 INHIBITORS SCHERING AKTIENGESELLSCHAFT (DE) 2003-10-02 WO disclosed