SCHEMBL7469972

SCHEMBL7469972

Fc1cc2ncnc(NCCc3ccccc3F)c2cc1F

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 2/20 0.51
▸ BRD4 O60885 1/20 0.51
▸ ERBB2 P04626 1/20 0.51
▸ ERBB4 Q15303 1/20 0.51
▸ NTRK1 P04629 1/20 0.50
▸ MAPK1 P28482 4/20 0.49
▸ KMT2A Q03164 4/20 0.48
▸ HTT P42858 4/20 0.48
▸ LMNA P02545 1/20 0.48
▸ APP P05067 1/20 0.48
▸ AURKA O14965 2/20 0.46
▸ CCNC P24863 1/20 0.45
▸ CDKN1A P38936 1/20 0.45
▸ CDK8 P49336 1/20 0.45
▸ CDK19 Q9BWU1 1/20 0.45
▸ MEN1 O00255 3/20 0.45
▸ PIK3CD O00329 1/20 0.43
▸ PIK3R1 P27986 1/20 0.43
▸ STAT3 P40763 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 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
SCHEMBL7470175 0.92 PIK3CD (0.50) EGFRBRD4ERBB2ERBB4NTRK1
SCHEMBL9921372 0.87 HTT (0.62) EGFRBRD4ERBB2ERBB4MAPK1
SCHEMBL7461677 0.81 HTR1A (0.46) EGFRBRD4ERBB2ERBB4NTRK1
SCHEMBL7474806 0.80 EGFR (0.52) EGFRBRD4ERBB2ERBB4NTRK1
SCHEMBL7468656 0.80 HTT (0.67) EGFRERBB2NTRK1MAPK1KMT2A
SCHEMBL7464247 0.77 HTT (0.74) NTRK1MAPK1KMT2AHTTAURKA
SCHEMBL8498737 0.76 EGFR (0.59) EGFRBRD4ERBB2ERBB4MAPK1
SCHEMBL8482940 0.76 MEN1 (0.77) EGFRMAPK1KMT2AHTTLMNA
SCHEMBL9921375 0.76 HTT (0.65) EGFRBRD4ERBB2ERBB4MAPK1
SCHEMBL5428633 0.75 TRPV1 (0.58) EGFRMAPK1

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
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