SCHEMBL8490245

SCHEMBL8490245

NCc1cccc(CNc2ncc3ncnc(Nc4ccc(F)c(Cl)c4)c3n2)c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 11/20 0.54
ERBB2 P04626 3/20 0.54
HPGD P15428 1/20 0.54
HTT P42858 1/20 0.54
GRM1 Q13255 1/20 0.49
CSNK2A1 P68400 2/20 0.47
MAPT P10636 1/20 0.47
STK17A Q9UEE5 2/20 0.46
STK17B O94768 1/20 0.46
MAP3K8 P41279 1/20 0.44
AURKA O14965 1/20 0.43
RPS6KB1 P23443 1/20 0.43
FBP1 P09467 1/20 0.43
NTRK1 P04629 1/20 0.42

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
SCHEMBL8490032 0.93 EGFR (0.57) EGFRERBB2HPGDHTTGRM1
SCHEMBL6994800 0.87 EGFR (0.60) EGFRERBB2HPGDHTTGRM1
SCHEMBL6993122 0.85 EGFR (0.60) EGFRERBB2HPGDHTTGRM1
SCHEMBL8483667 0.85 EGFR (0.58) EGFRERBB2HPGDHTTGRM1
SCHEMBL6989432 0.84 STK17A (0.62) EGFRERBB2HPGDHTTGRM1
SCHEMBL6990324 0.83 STK17A (0.59) EGFRERBB2HPGDHTTGRM1
SCHEMBL6992551 0.82 EGFR (0.59) EGFRERBB2HPGDHTTGRM1
SCHEMBL8488667 0.81 CSNK2A1 (0.62) EGFRERBB2HPGDHTTGRM1
SCHEMBL8314941 0.80 EGFR (0.55) EGFRERBB2HPGDHTTGRM1
SCHEMBL6993332 0.80 EGFR (0.59) EGFRERBB2HPGDHTTGRM1

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
US-5977102-A INHIBITORY EFFECT ON SIGNAL TRANSDUCTION MEDIATED BY TYROSINE KINASES OR EPIDERMAL GROWTH FACTOR; ANTITUMOR,-CARCINOGENIC, -METASTASIS,-PROLIFERATION AGENTS AND -INFLAMMATORY AGENTS; PSORIASIS; ANGIOGENESIS INHIBITORS; IMMUNOLOGY; DR. KARL THOMAE GMBH (DE) 1999-11-02 US disclosed