SCHEMBL23866189

SCHEMBL23866189

C=CC(=O)N1CCCC(Nc2nc(Nc3ccc(N4CCN(C5COC5)CC4C)cn3)c3c(c2F)CCC=CC3=O)C1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.77
▸ EGFR P00533 16/20 0.77

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
SCHEMBL21707062 0.87 BTK (1.00) BTKEGFR
SCHEMBL23866199 0.81 EGFR (0.70) BTKEGFR
SCHEMBL22222658 0.78 BTK (0.85) BTKEGFR
SCHEMBL23865960 0.78 BTK (0.70) BTKEGFR
SCHEMBL22296402 0.74 BTK (0.60) BTKEGFR
SCHEMBL22222601 0.73 BTK (1.00) BTKEGFR
SCHEMBL23866019 0.73 BTK (0.79) BTKEGFR
SCHEMBL22222750 0.73 BTK (0.81) BTKEGFR
SCHEMBL22296206 0.71 BTK (0.73) BTKEGFR
SCHEMBL21706940 0.70 BTK (1.00) BTKEGFR

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-3689871-B1 4,6,7-TRISUBSTITUTED 1,2-DIHYDROPYRROL[3,4-C]PYRIDIN/PYRIMIDIN-3-ONE DERIVATIVE AND USE SHANGHAI HAIYAN PHARMACEUTICAL TECH CO LTD (CN) 2021-09-29 — — EP disclosed
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