SCHEMBL11246685

SCHEMBL11246685

O=[N+]([O-])c1cccc2ncnc(Cl)c12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 4/20 0.55
POLB P06746 2/20 0.46
GPR35 Q9HC97 1/20 0.44
TDP1 Q9NUW8 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 1/20 0.43
TXNRD1 Q16881 1/20 0.42
TXNRD3 Q86VQ6 1/20 0.42
TXNRD2 Q9NNW7 1/20 0.42
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
FGFR1 P11362 1/20 0.40
PDE10A Q9Y233 1/20 0.40
NCOA1 Q15788 1/20 0.40
NCOA3 Q9Y6Q9 1/20 0.40
HTT P42858 1/20 0.37

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
SCHEMBL28998207 0.80 TDP1 (0.46) EGFRTDP1ALDH1A1MEN1KMT2A
SCHEMBL28455625 0.78 EGFR (0.37) EGFRTDP1ALDH1A1PDE4APDE4B
SCHEMBL4905093 0.77 ALDH1A1 (0.58) EGFRPOLBGPR35TDP1ALDH1A1
SCHEMBL26616688 0.77 ALDH1A1 (0.44) EGFRPOLBGPR35TDP1ALDH1A1
SCHEMBL3107938 0.74 ALDH1A1 (0.49) EGFRPOLBTDP1ALDH1A1MEN1
SCHEMBL26006397 0.74 MERTK (0.38) EGFRTDP1ALDH1A1MEN1KMT2A
SCHEMBL2098010 0.73 ALDH1A1 (0.62) POLBGPR35TDP1ALDH1A1MEN1
SCHEMBL6634280 0.73 PDE10A (0.51) POLBGPR35TDP1ALDH1A1MEN1
SCHEMBL8856272 0.73 TSHR (0.45) EGFRPOLBTDP1ALDH1A1MEN1
SCHEMBL8808732 0.72 PDE4A (0.52) EGFRTDP1PDE4APDE4BPDE4C

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4323680-A 4-Aminoquinazoline compounds useful as agricultural fungicides SANKYO COMPANY LIMITED (JP) 1982-04-06 US disclosed
US-4213987-A 4-AMINOQUINAZOLINES SANKYO COMPANY LIMITED (JP) 1980-07-22 US disclosed