SCHEMBL7457697

SCHEMBL7457697

O=[N+]([O-])c1cc2c(NCCNc3ccccc3)ncnc2cc1Cl

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 12/20 0.62
PDGFRB P09619 1/20 0.45
FBP1 P09467 1/20 0.45
MEN1 O00255 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL7474181 0.88 MAPK1 (0.56) EGFRMAPTSMN1; SMN2
SCHEMBL7471567 0.86 PIK3CD (0.62) EGFRMAPT
SCHEMBL7475194 0.85 EGFR (0.66) EGFRSMN1; SMN2
SCHEMBL7469700 0.84 EGFR (0.54) EGFRMAPT
SCHEMBL7474806 0.84 EGFR (0.52) EGFRPDGFRBMAPT
SCHEMBL7474113 0.83 EGFR (0.55) EGFRPDGFRBFBP1MAPT
SCHEMBL7461530 0.83 PKM (0.56) EGFRMAPTSMN1; SMN2
SCHEMBL7463424 0.82 EGFR (0.50) EGFRPDGFRBMEN1MAPTKMT2A
SCHEMBL7464363 0.81 HTT (0.54) EGFRMEN1KMT2ASMN1; SMN2
SCHEMBL7465660 0.81 EGFR (0.56) EGFRMEN1MAPTKMT2ASMN1; SMN2

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