SCHEMBL30748527

SCHEMBL30748527

COc1cc(N2CCOCC2)c(-c2ccsc2)cc1Nc1ncc(Br)c(Nc2ccc3nccnc3c2P(C)C)n1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.48
▸ ULK1 O75385 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
SCHEMBL25001639 1.00 EGFR (0.48) EGFRULK1
SCHEMBL25002978 0.89 EGFR (0.48) EGFRULK1
SCHEMBL25001890 0.89 EGFR (0.55) EGFR
SCHEMBL23441963 0.88 EGFR (0.63) EGFR
SCHEMBL30748525 0.88 EGFR (0.48) EGFRULK1
SCHEMBL25001499 0.88 EGFR (0.48) EGFRULK1
SCHEMBL25001612 0.87 EGFR (0.51) EGFRULK1
SCHEMBL25001622 0.86 EGFR (0.48) EGFR
SCHEMBL25002039 0.86 EGFR (0.50) EGFRULK1
SCHEMBL25001524 0.86 EGFR (0.47) EGFRULK1

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
CN-112538072-B Aminopyrimidine EGFR inhibitors 齐鲁制药有限公司 2024-02-06 — — CN disclosed
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