SCHEMBL23865807

SCHEMBL23865807

C[C@H]1CN(C2COC2)CCN1c1cc(F)ccc1Nc1nc(N[C@@H]2CCCN(C)C2)c(F)c2c1C(=O)NC2

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.64
▸ EGFR P00533 16/20 0.58

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
SCHEMBL22222750 0.89 BTK (0.81) BTKEGFR
SCHEMBL22222601 0.78 BTK (1.00) BTKEGFR
SCHEMBL22457564 0.76 BTK (0.69) BTKEGFR
SCHEMBL22222658 0.76 BTK (0.85) BTKEGFR
SCHEMBL21707073 0.74 BTK (1.00) BTKEGFR
SCHEMBL21707062 0.74 BTK (1.00) BTKEGFR
SCHEMBL22296416 0.72 BTK (0.58) BTKEGFR
SCHEMBL21707075 0.69 BTK (1.00) BTKEGFR
SCHEMBL21706985 0.68 BTK (0.83) BTKEGFR
SCHEMBL28536320 0.65 BTK (0.83) 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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