SCHEMBL30221585

SCHEMBL30221585

CCN(CCN(C)C)c1ccc(Nc2ncc(Cl)c(-c3cn(C)c4ccccc34)n2)cc1NC(C)=O

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.60
▸ KCNH2 Q12809 2/20 0.57
▸ IGF1R P08069 1/20 0.57
▸ CDK7 P50613 1/20 0.55
▸ CCNH P51946 1/20 0.55

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
SCHEMBL24900518 1.00 EGFR (0.60) EGFRKCNH2IGF1RCDK7CCNH
SCHEMBL24900840 0.92 EGFR (0.65) EGFRKCNH2IGF1RCDK7CCNH
SCHEMBL30221613 0.92 EGFR (0.65) EGFRKCNH2IGF1RCDK7CCNH
SCHEMBL30221441 0.89 EGFR (0.55) EGFRKCNH2IGF1R
SCHEMBL24900697 0.89 EGFR (0.55) EGFRKCNH2IGF1R
SCHEMBL30221344 0.89 EGFR (0.58) EGFRKCNH2IGF1RCDK7CCNH
SCHEMBL24900615 0.89 EGFR (0.58) EGFRKCNH2IGF1RCDK7CCNH
SCHEMBL24900821 0.89 EGFR (0.59) EGFRKCNH2IGF1RCDK7CCNH
SCHEMBL24900808 0.89 EGFR (0.55) EGFRKCNH2IGF1RCDK7CCNH
SCHEMBL30221498 0.89 EGFR (0.55) EGFRKCNH2IGF1RCDK7CCNH

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
WO-2023287783-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF ACEA Therapeutics, Inc. (US) 2023-01-19 — — WO disclosed
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