SCHEMBL7465224

SCHEMBL7465224

O=[N+]([O-])c1cc2c(NCc3ccc(F)c(F)c3)ncnc2cc1N1CCNCC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
EGFR P00533 3/20 0.42
HTR6 P50406 3/20 0.42
CHRM4 P08173 1/20 0.41
AURKA O14965 1/20 0.40
RPS6KB1 P23443 1/20 0.40
MET P08581 1/20 0.40
WDR5 P61964 1/20 0.40
KMT2A Q03164 1/20 0.40
ABL1 P00519 1/20 0.39
SRC P12931 1/20 0.39
USP10 Q14694 1/20 0.39
PIK3C3 Q8NEB9 1/20 0.39
USP13 Q92995 1/20 0.39

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
SCHEMBL7463091 0.91 USP10 (0.50) MAPTLMNAGAAALDH1A1SMN1; SMN2
SCHEMBL7465445 0.89 HTR6 (0.55) EGFRHTR6WDR5KMT2A
SCHEMBL7470232 0.89 CLK4 (0.46) EGFRHTR6AURKARPS6KB1MET
SCHEMBL7475684 0.88 EGFR (0.53) MAPTLMNAGAAALDH1A1EGFR
SCHEMBL7473662 0.88 USP10 (0.47) MAPTLMNAGAAALDH1A1SMN1; SMN2
SCHEMBL7466331 0.87 ALDH1A1 (0.48) MAPTLMNAALDH1A1EGFRHTR6
SCHEMBL7458928 0.87 EGFR (0.47) MAPTLMNAGAAALDH1A1SMN1; SMN2
SCHEMBL7468826 0.87 EGFR (0.56) MAPTLMNAGAAALDH1A1SMN1; SMN2
SCHEMBL7525155 0.87 EGFR (0.48) MAPTLMNASMN1; SMN2EGFRHTR6
SCHEMBL7468699 0.86 PDE5A (0.44) MAPTLMNAGAAALDH1A1EGFR

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