SCHEMBL28795444

SCHEMBL28795444

COc1cc(N2CCC3(CC2)CN(C2CN(c4ccc5c(c4)C(=O)N(C4CCC(=O)NC4=O)C5=O)C2)C3)c(C)cc1N

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 12/20 0.52
▸ AR P10275 2/20 0.45
▸ DDB1 Q16531 9/20 0.44
▸ BTK Q06187 1/20 0.43
▸ MAP4K1 Q92918 1/20 0.40
▸ ALK Q9UM73 2/20 0.39
▸ IKZF1 Q13422 1/20 0.39
▸ IKZF2 Q9UKS7 1/20 0.39
▸ BRD9 Q9H8M2 1/20 0.38
▸ GSPT1 P15170 1/20 0.38

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
SCHEMBL28795236 0.95 CRBN (0.51) CRBNARDDB1BTKMAP4K1
SCHEMBL28795420 0.93 CRBN (0.49) CRBNARDDB1BTKMAP4K1
SCHEMBL28795226 0.90 CRBN (0.52) CRBNARDDB1BTKMAP4K1
SCHEMBL28795307 0.90 CRBN (0.51) CRBNARDDB1BTKMAP4K1
SCHEMBL28795225 0.89 CRBN (0.53) CRBNARDDB1BTKIKZF1
SCHEMBL28795241 0.89 CRBN (0.49) CRBNARDDB1BTKMAP4K1
SCHEMBL28795377 0.86 CRBN (0.50) CRBNARDDB1BTKALK
SCHEMBL28795151 0.86 CRBN (0.57) CRBNARDDB1BTKIKZF1
SCHEMBL28795113 0.86 CRBN (0.56) CRBNARDDB1BTKIKZF1
SCHEMBL29803017 0.86 CRBN (0.56) CRBNARDDB1BTKIKZF1

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
CN-114805303-A Molecule with double functions of degrading EGFR (epidermal growth factor receptor), composition and pharmaceutical application thereof 海思科医药集团股份有限公司 2022-07-29 — — CN disclosed
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