SCHEMBL7802850

SCHEMBL7802850

CNc1cc2c(Nc3cccc(C)c3)ncnc2cc1F

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 15/20 0.66
▸ ERBB2 P04626 2/20 0.66
▸ MAPK1 P28482 2/20 0.60
▸ HTT P42858 2/20 0.60
▸ HIF1A Q16665 1/20 0.60
▸ KDM4E B2RXH2 1/20 0.52
▸ CD38 P28907 1/20 0.51

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
SCHEMBL7811115 0.89 EGFR (0.60) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL7809386 0.86 EGFR (0.69) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL7802759 0.86 EGFR (0.67) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL8312640 0.85 EGFR (0.77) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL7811790 0.85 EGFR (0.56) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL7811745 0.82 EGFR (0.64) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL7809310 0.82 EGFR (0.59) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL7802729 0.82 EGFR (0.71) EGFRERBB2
Hydrochloric Acid SCHEMBL7809217 0.81 EGFR (0.80) EGFRERBB2MAPK1HTTHIF1A
Hydrochloric Acid SCHEMBL7811950 0.81 EGFR (0.58) EGFRERBB2MAPK1HTTHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0635498-B1 Quinazoline derivatives and their use as anti-cancer agents SYNGENTA LTD (GB) 2001-04-18 — — EP disclosed
US-5475001-A Quinazoline derivatives ZENECA LIMITED (GB) 1995-12-12 — — US disclosed
WO-1995003283-A1 QUINAZOLINE DERIVATIVES AND THEIR USE AS ANTI-CANCER AGENTS ZENECA LIMITED (GB) 1995-02-02 — — WO disclosed
EP-0635498-A1 Quinazoline derivatives and their use as anti-cancer agents ZENECA LIMITED (GB) 1995-01-25 — — EP disclosed
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