SCHEMBL7474845

SCHEMBL7474845

CN(Cc1ccccc1)c1ncnc2cc(Cl)c([N+](=O)[O-])cc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
PIK3CD O00329 1/20 0.55
PIK3R1 P27986 1/20 0.55
HTT P42858 1/20 0.55
HIF1A Q16665 1/20 0.55
CSF1R P07333 5/20 0.46
EGFR P00533 3/20 0.45
ALDH1A1 P00352 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RPS6KB1 P23443 1/20 0.43
RAB9A P51151 3/20 0.43
TSHR P16473 2/20 0.43
MAPK1 P28482 2/20 0.43
KDM4E B2RXH2 2/20 0.43

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
SCHEMBL7462398 0.89 EGFR (0.47) LMNASMN1; SMN2PIK3CDPIK3R1HTT
SCHEMBL7472729 0.87 EGFR (0.45) LMNASMN1; SMN2PIK3CDPIK3R1HTT
SCHEMBL8825693 0.83 LMNA (0.51) LMNASMN1; SMN2PIK3CDPIK3R1HTT
SCHEMBL7469735 0.79 LMNA (0.47) LMNASMN1; SMN2PIK3CDPIK3R1HTT
SCHEMBL7466353 0.78 EGFR (0.47) LMNASMN1; SMN2CSF1REGFRALDH1A1
SCHEMBL7470671 0.78 SMN1; SMN2 (0.47) SMN1; SMN2HTTCSF1REGFRALDH1A1
SCHEMBL12459324 0.77 LMNA (0.73) LMNASMN1; SMN2PIK3CDPIK3R1HTT
SCHEMBL7469896 0.76 EGFR (0.46) LMNACSF1REGFRALDH1A1MAPT
SCHEMBL7475194 0.75 EGFR (0.66) LMNASMN1; SMN2HTTEGFRRAB9A
SCHEMBL7472217 0.75 EGFR (0.44) LMNACSF1REGFRMAPTPDGFRB

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