SCHEMBL7468656

SCHEMBL7468656

Fc1ccc(CCNc2ncnc3cc(F)c(F)cc23)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 6/20 0.67
NTRK1 P04629 3/20 0.59
USP10 Q14694 1/20 0.57
PIK3C3 Q8NEB9 1/20 0.57
USP13 Q92995 1/20 0.57
MAPK1 P28482 3/20 0.53
MEN1 O00255 1/20 0.53
STAT3 P40763 1/20 0.53
KMT2A Q03164 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
NR2F2 P24468 1/20 0.53
EGFR P00533 4/20 0.52
LMNA P02545 1/20 0.52
APP P05067 1/20 0.52
ERBB2 P04626 2/20 0.52
AURKA O14965 4/20 0.52
CCNC P24863 1/20 0.49
CDKN1A P38936 1/20 0.49
CDK8 P49336 1/20 0.49
CDK19 Q9BWU1 1/20 0.49

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
SCHEMBL7470174 0.92 HTT (0.57) HTTNTRK1USP10PIK3C3USP13
SCHEMBL7464247 0.89 HTT (0.74) HTTNTRK1MAPK1MEN1STAT3
SCHEMBL7469214 0.86 USP10 (0.76) HTTUSP10PIK3C3USP13MAPK1
SCHEMBL9921342 0.83 HTT (0.73) HTTNTRK1USP10PIK3C3USP13
SCHEMBL7461671 0.81 HTT (0.52) HTTNTRK1USP10PIK3C3USP13
SCHEMBL7467527 0.80 PDE5A (0.64) MEN1KMT2ASMN1; SMN2
SCHEMBL9921353 0.80 HTT (0.77) HTTUSP10PIK3C3USP13MAPK1
SCHEMBL9921352 0.80 HTT (0.81) HTTUSP10PIK3C3USP13MAPK1
SCHEMBL13191858 0.80 HTT (1.00) HTTUSP10PIK3C3USP13MAPK1
SCHEMBL7469972 0.80 EGFR (0.51) HTTNTRK1MAPK1MEN1STAT3

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