SCHEMBL22296420

SCHEMBL22296420

CN1CCCC(N(C)c2nc(Nc3ccc(N4CCOCC4)cc3)c3c(c2F)CNC3=O)C1

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.77
▸ EGFR P00533 15/20 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
SCHEMBL21707230 0.87 BTK (1.00) BTKEGFR
SCHEMBL22222665 0.87 BTK (0.70) BTKEGFR
SCHEMBL21706984 0.85 BTK (1.00) BTKEGFR
SCHEMBL21706983 0.79 BTK (1.00) BTKEGFR
SCHEMBL22457564 0.74 BTK (0.69) BTKEGFR
SCHEMBL29044572 0.74 BTK (0.55) BTKEGFR
SCHEMBL21706936 0.72 BTK (1.00) BTKEGFR
SCHEMBL21707234 0.72 BTK (1.00) BTKEGFR
SCHEMBL23865995 0.72 BTK (0.54) BTKEGFR
SCHEMBL21706944 0.71 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-A1 4,6,7-TRISUBSTITUTED 1,2-DIHYDROPYRROL[3,4-C]PYRIDIN/PYRIMIDIN-3-ONE DERIVATIVE AND USE Shanghai Haiyan Pharmaceutical Technology Co., Ltd. (CN) 2020-08-05 — — EP disclosed
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