SCHEMBL7473397

SCHEMBL7473397

O=[N+]([O-])c1cc2c(NCc3ccc4c(c3)OCO4)ncnc2cc1N1CCNCC1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 18/20 0.59
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
CLK4 Q9HAZ1 2/20 0.51

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
SCHEMBL7465985 0.97 PDE5A (0.55) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7468592 0.95 PDE5A (0.52) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7469494 0.90 PDE5A (0.46) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7470773 0.90 PDE5A (0.59) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7468674 0.88 PDE5A (0.57) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7466788 0.88 PDE5A (0.57) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7466273 0.88 PDE5A (0.57) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7468081 0.86 KMT2A (0.42) PDE5AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7475684 0.86 EGFR (0.53) KMT2AALDH1A1
SCHEMBL7474860 0.85 KMT2A (0.53) MEN1KMT2AALDH1A1

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
EP-1229025-A1 NOVEL QUINAZOLINE DERIVATIVES Japan Energy Corporation (JP) 2002-08-07 EP disclosed