SCHEMBL30692638

SCHEMBL30692638

COc1cc(N2CCC(N3CCCN(C)CC3)CC2)c(Cl)cc1Nc1ncc(Cl)c(Nc2cc(Cl)ccc2NS(C)(=O)=O)n1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 13/20 0.69
▸ INSR P06213 7/20 0.60
▸ IGF1R P08069 7/20 0.60
▸ ALK Q9UM73 7/20 0.60
▸ MET P08581 1/20 0.57

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
SCHEMBL26906638 1.00 EGFR (0.69) EGFRINSRIGF1RALKMET
SCHEMBL26906804 0.97 EGFR (0.73) EGFRINSRIGF1RALKMET
SCHEMBL26906680 0.94 EGFR (0.61) EGFRINSRIGF1RALK
SCHEMBL26906840 0.94 EGFR (0.69) EGFRINSRIGF1RALKMET
SCHEMBL26906853 0.92 EGFR (0.71) EGFRINSRIGF1RALKMET
SCHEMBL26906674 0.91 EGFR (0.64) EGFRINSRIGF1RALK
SCHEMBL26906822 0.91 EGFR (0.72) EGFRINSRIGF1RALKMET
SCHEMBL26906637 0.90 EGFR (0.82) EGFRINSRIGF1RALKMET
SCHEMBL26906550 0.90 EGFR (0.66) EGFRINSRIGF1RALKMET
SCHEMBL26906764 0.90 EGFR (0.70) EGFRINSRIGF1RALKMET

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-4286376-A1 PYRIMIDINE DERIVATIVE HAVING PROTEIN KINASE INHIBITORY ACTIVITY, AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME Therapex Co., Ltd. (KR) 2023-12-06 — — EP disclosed
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