SCHEMBL7475448

SCHEMBL7475448

O=[N+]([O-])c1cc2c(NCc3ccc(OCc4ccccc4)cc3)ncnc2cc1Cl

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.56
HTT P42858 3/20 0.48
LMNA P02545 2/20 0.48
MAPT P10636 1/20 0.48
KDM4E B2RXH2 1/20 0.48
HPGD P15428 1/20 0.48
LCK P06239 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL7475194 0.91 EGFR (0.66) EGFRHTTLMNAKDM4EHPGD
SCHEMBL7474668 0.86 HTT (0.63) EGFRHTTLMNAKDM4EHPGD
SCHEMBL7473897 0.85 EGFR (0.55) EGFRHTT
SCHEMBL7473179 0.85 MAPK1 (0.58) EGFRHTTLMNAMAPT
SCHEMBL7472725 0.84 EGFR (0.61) EGFRHTT
SCHEMBL7465009 0.83 HTT (0.57) EGFRHTTLMNAMAPTKDM4E
SCHEMBL7461665 0.83 USP10 (0.59) EGFRHTTLMNA
SCHEMBL7470641 0.82 EGFR (0.50) EGFRLMNA
SCHEMBL7460925 0.82 EGFR (0.48) EGFRHTTLMNAMAPTKDM4E
SCHEMBL7470418 0.82 MAPK1 (0.65) EGFRHTTLMNASMN1; 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