SCHEMBL8083244

SCHEMBL8083244

Cc1cccc(Nc2ncnc3cc(O)c(NCCO)cc23)c1

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 16/20 0.56
▸ ERBB2 P04626 3/20 0.55
▸ MAPK1 P28482 2/20 0.55
▸ HTT P42858 2/20 0.54
▸ HIF1A Q16665 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.50

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
SCHEMBL8083408 0.89 EGFR (0.58) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL8082240 0.86 EGFR (0.71) EGFRERBB2MAPK1HIF1AKDM4E
SCHEMBL8871418 0.84 EGFR (0.71) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL8871347 0.83 EGFR (0.62) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL2100551 0.77 EGFR (0.82) EGFRERBB2MAPK1HIF1AKDM4E
SCHEMBL8872430 0.76 EGFR (0.72) EGFRERBB2MAPK1
SCHEMBL8075043 0.76 EGFR (0.71) EGFRERBB2MAPK1HIF1AKDM4E
SCHEMBL8871490 0.75 EGFR (0.72) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL9215676 0.75 EGFR (0.74) EGFRERBB2MAPK1HTTHIF1A
SCHEMBL2102382 0.75 EGFR (0.82) EGFRERBB2MAPK1HIF1AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0823901-B1 QUINAZOLINE DERIVATIVE ZENECA LTD (GB) 2000-10-18 — — EP claimed
EP-0823901-A1 QUINAZOLINE DERIVATIVE ZENECA LIMITED (GB) 1998-02-18 — — EP claimed
WO-1996033981-A1 QUINAZOLINE DERIVATIVE ZENECA LIMITED (GB) 1996-10-31 — — WO claimed
EP-0823901-B1 QUINAZOLINE DERIVATIVE ZENECA LTD (GB) 2000-10-18 — — EP disclosed
US-5952333-A INHIBITOR OF TYROSINE KINASE RECEPTOR FOR TREATING PROLIFERATIVE DISEASE SUCH AS CANCER ZENECA LIMITED (GB) 1999-09-14 — — US disclosed
EP-0823901-A1 QUINAZOLINE DERIVATIVE ZENECA LIMITED (GB) 1998-02-18 — — EP disclosed
WO-1996033981-A1 QUINAZOLINE DERIVATIVE ZENECA LIMITED (GB) 1996-10-31 — — WO disclosed
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