SCHEMBL30860332

SCHEMBL30860332

CN(C)C1CCN(C2CCN(c3cc(Cl)c(Nc4ncc(Br)c(Nc5cc6c(cc5NS(C)(=O)=O)CCO6)n4)cc3Cl)CC2)C1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.49
▸ ALK Q9UM73 1/20 0.39

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
SCHEMBL30860331 0.96 EGFR (0.47) EGFR
SCHEMBL26906936 0.95 EGFR (0.56) EGFRALK
SCHEMBL26906665 0.91 EGFR (0.53) EGFR
SCHEMBL30860358 0.91 EGFR (0.49) EGFRALK
SCHEMBL30860387 0.90 EGFR (0.47) EGFRALK
SCHEMBL26906596 0.90 EGFR (0.55) EGFR
SCHEMBL26906557 0.90 EGFR (0.53) EGFRALK
SCHEMBL26906882 0.89 EGFR (0.49) EGFRALK
SCHEMBL30860404 0.87 EGFR (0.51) EGFRALK
SCHEMBL26906670 0.87 EGFR (0.66) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024072075-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 테라펙스 2024-04-04 — — WO claimed
WO-2024072075-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 테라펙스 2024-04-04 — — WO disclosed
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