SCHEMBL7464247

SCHEMBL7464247

Fc1cc2ncnc(NCCc3ccc(Cl)cc3)c2cc1F

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 6/20 0.74
NTRK1 P04629 5/20 0.66
NR2F2 P24468 1/20 0.64
CNR1 P21554 2/20 0.58
CNR2 P34972 2/20 0.58
TTBK1 Q5TCY1 1/20 0.57
TTBK2 Q6IQ55 1/20 0.57
CYP1A2 P05177 1/20 0.54
CYP2D6 P10635 1/20 0.54
AURKA O14965 4/20 0.54
PIK3CD O00329 1/20 0.54
PIK3R1 P27986 1/20 0.54
AURKB Q96GD4 1/20 0.52
MAPK1 P28482 3/20 0.51
MEN1 O00255 1/20 0.51
STAT3 P40763 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 1/20 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
SCHEMBL7468656 0.89 HTT (0.67) HTTNTRK1NR2F2AURKAMAPK1
SCHEMBL9921352 0.86 HTT (0.81) HTTNR2F2CNR1CNR2TTBK1
SCHEMBL7469491 0.82 HTT (0.56) HTTNTRK1NR2F2CNR1CNR2
SCHEMBL8545770 0.82 HTT (0.82) HTTNR2F2CNR1CNR2TTBK1
SCHEMBL7470174 0.82 HTT (0.57) HTTNTRK1NR2F2AURKAPIK3CD
SCHEMBL9921421 0.79 PIK3CD (0.70) HTTNR2F2CNR1CNR2CYP1A2
SCHEMBL7467527 0.78 PDE5A (0.64) MEN1KMT2ASMN1; SMN2
SCHEMBL19160676 0.78 HTT (0.85) HTTNR2F2CNR1CNR2TTBK1
SCHEMBL18733232 0.78 HTT (1.00) HTTNR2F2CNR1CNR2TTBK1
SCHEMBL8543977 0.78 HTT (0.64) HTTNTRK1NR2F2CNR1CNR2

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