SCHEMBL7470615

SCHEMBL7470615

NC1CCN(c2cc3ncnc(NCCc4ccc(Cl)cc4)c3cc2[N+](=O)[O-])CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.50
HRH4 Q9H3N8 1/20 0.45
NR2F2 P24468 1/20 0.45
CDK1 P06493 1/20 0.44
TTBK1 Q5TCY1 1/20 0.42
TTBK2 Q6IQ55 1/20 0.42
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
DNMT1 P26358 1/20 0.40
DNMT3A Q9Y6K1 1/20 0.40
MAPT P10636 3/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PDE5A O76074 1/20 0.39
NTRK1 P04629 1/20 0.39
PIK3CD O00329 1/20 0.39
PIK3R1 P27986 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 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
SCHEMBL7469787 0.92 HTT (0.48) HTTHRH4NR2F2TTBK1TTBK2
SCHEMBL7470361 0.91 HTT (0.45) HTTHRH4NR2F2CDK1MEN1
SCHEMBL7468943 0.91 MAPK1 (0.46) HTTCDK1CNR1CNR2MAPT
SCHEMBL7474097 0.88 HRH4 (0.56) HTTHRH4NR2F2CDK1TTBK1
SCHEMBL7471116 0.88 HTT (0.52) HTTHRH4NR2F2TTBK1TTBK2
SCHEMBL7470182 0.86 HTT (0.50) HTTHRH4NR2F2TTBK1TTBK2
SCHEMBL7470593 0.86 HTT (0.50) HTTHRH4NR2F2TTBK1TTBK2
SCHEMBL7463152 0.85 HTT (0.48) HTTHRH4NR2F2CDK1CNR1
SCHEMBL7466405 0.85 HTT (0.48) HTTHRH4NR2F2TTBK1TTBK2
SCHEMBL7466801 0.85 HTT (0.48) HTTHRH4NR2F2CDK1TTBK1

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