SCHEMBL8320030

SCHEMBL8320030

Cc1cccc(Nc2ncnc3cnc(NCC(=O)N4CCOCC4)nc23)c1

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.71
KDM4E B2RXH2 1/20 0.47
RAB9A P51151 1/20 0.47
SYK P43405 1/20 0.47
BRAF P15056 2/20 0.45
BTK Q06187 1/20 0.45

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
SCHEMBL8315707 0.92 EGFR (0.62) EGFRSYKBRAF
SCHEMBL8318445 0.84 EGFR (0.64) EGFRKDM4ERAB9ABRAF
SCHEMBL8319191 0.83 EGFR (0.69) EGFRSYK
SCHEMBL8798588 0.83 EGFR (1.00) EGFRBRAF
SCHEMBL8318142 0.82 EGFR (0.68) EGFRSYK
SCHEMBL8314519 0.82 EGFR (0.60) EGFRKDM4ERAB9ASYKBRAF
SCHEMBL8314526 0.82 EGFR (0.60) EGFRKDM4ERAB9ASYKBRAF
SCHEMBL8318904 0.82 EGFR (0.70) EGFRSYK
SCHEMBL8316349 0.81 EGFR (0.66) EGFRSYK
SCHEMBL8318090 0.78 EGFR (0.77) EGFR

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-0779888-B1 PYRIMIDO [5,4-D]PYRIMIDINES, DRUGS CONTAINING THESE COMPOUNDS, THEIR USE, AND PROCESS FOR PREPARING THEM BOEHRINGER INGELHEIM PHARMA (DE) 1999-04-28 EP disclosed