SCHEMBL7464129

SCHEMBL7464129

COc1ccc(CCNc2ncnc3cc(Cl)c([N+](=O)[O-])cc23)cc1OC

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.69
SMN1; SMN2 Q16637 3/20 0.69
MEN1 O00255 1/20 0.69
STAT3 P40763 1/20 0.69
KMT2A Q03164 1/20 0.69
APP P05067 2/20 0.60
MAPT P10636 4/20 0.53
HTT P42858 3/20 0.53
LMNA P02545 2/20 0.53
NPC1 O15118 2/20 0.53
GALR3 O60755 2/20 0.53
NR2F2 P24468 2/20 0.53
RAB9A P51151 2/20 0.53
POLB P06746 2/20 0.53
TSHR P16473 2/20 0.53
PDE5A O76074 1/20 0.53
STAT1 P42224 1/20 0.52
AURKA O14965 1/20 0.50
KDM4E B2RXH2 1/20 0.48
RECQL P46063 1/20 0.48

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
SCHEMBL7473060 0.90 STAT1 (0.64) MAPK1SMN1; SMN2MEN1STAT3KMT2A
SCHEMBL7465161 0.88 PDE5A (0.52) MAPK1SMN1; SMN2MEN1STAT3KMT2A
SCHEMBL7467508 0.86 MAPK1 (0.52) MAPK1SMN1; SMN2MEN1STAT3KMT2A
SCHEMBL7475626 0.85 HTT (0.52) MAPK1SMN1; SMN2MEN1STAT3KMT2A
SCHEMBL7469664 0.85 HTT (0.63) MAPK1MEN1KMT2AMAPTHTT
SCHEMBL7465156 0.85 MAPK1 (0.53) MAPK1SMN1; SMN2MEN1STAT3KMT2A
SCHEMBL7469795 0.84 EGFR (0.60) MAPK1SMN1; SMN2MEN1STAT3KMT2A
SCHEMBL7465501 0.83 STAT1 (0.56) MAPK1MEN1KMT2AHTTLMNA
SCHEMBL7474665 0.83 HTT (0.62) MAPK1SMN1; SMN2MEN1STAT3KMT2A
SCHEMBL7464363 0.83 HTT (0.54) MAPK1SMN1; SMN2MEN1STAT3KMT2A

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