SCHEMBL7407384

SCHEMBL7407384

Nc1cc(C(Cc2ccc3cncnc3c2)N2CCNCC2=O)oc1-c1cccc([N+](=O)[O-])c1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 4/20 0.33
CFTR P13569 2/20 0.32
MEN1 O00255 1/20 0.31
ELANE P08246 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
CYP1A2 P05177 1/20 0.31
CMA1 P23946 1/20 0.31
ITGB1 P05556 1/20 0.30
ITGA4 P13612 1/20 0.30

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
SCHEMBL7374157 0.68 F10 (0.32)
SCHEMBL7370841 0.68
SCHEMBL7375611 0.67 CDK2 (0.31)
SCHEMBL7409241 0.62 F10 (0.40)
SCHEMBL27892414 0.59 EGFR (0.51) MEN1KMT2ALMNAMAPTCYP1A2
SCHEMBL7554775 0.59 F10 (0.38)
SCHEMBL7407779 0.58 F10 (0.42)
SCHEMBL7553322 0.58 F10 (0.44)
SCHEMBL7451661 0.58 F10 (0.46)
SCHEMBL3978819 0.57 HPN (0.49) MEN1KMT2ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1051176-A4 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARM PROD INC (US) 2002-06-12 EP disclosed
EP-1051176-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2000-11-15 EP disclosed
WO-1999037304-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-07-29 WO disclosed