SCHEMBL7460872

SCHEMBL7460872

O=C(NC1CC1)C(Nc1ncnc2cc(Cl)c([N+](=O)[O-])cc12)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.47
PDGFRB P09619 1/20 0.42
ALDH1A1 P00352 7/20 0.38
MAPT P10636 4/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
NPC1 O15118 1/20 0.36
MITF O75030 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
KDM4E B2RXH2 3/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PKM P14618 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL7472430 0.83 SMN1; SMN2 (0.39) EGFRPDGFRBALDH1A1MAPTLMNA
SCHEMBL7473900 0.81 EGFR (0.56) EGFRPDGFRBMAPTLMNAABCG2
SCHEMBL7460996 0.81 EGFR (0.48) EGFRPDGFRBALDH1A1MAPTLMNA
SCHEMBL7529433 0.78 EGFR (0.51) EGFRPDGFRBALDH1A1MAPTLMNA
SCHEMBL7470644 0.76 EGFR (0.53) EGFRPDGFRBABCG2
SCHEMBL7466558 0.75 EGFR (0.46) EGFRPDGFRBABCG2CNR1
SCHEMBL7474113 0.74 EGFR (0.55) EGFRPDGFRBALDH1A1MAPTLMNA
SCHEMBL7475452 0.73 EGFR (0.52) EGFRPDGFRBABCG2
SCHEMBL7460865 0.73 CHRM4 (0.47) EGFRALDH1A1CNR1CNR2KMT2A
SCHEMBL7472380 0.72 EGFR (0.53) EGFRPDGFRBMAPTHTTABCG2

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