SCHEMBL28795151

SCHEMBL28795151

COc1cc(N2CCC(N3CCN(C4CCN(c5ccc6c(c5)C(=O)N(C5CCC(=O)NC5=O)C6=O)CC4)CC3)CC2)c(C)cc1N

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 15/20 0.57
▸ DDB1 Q16531 9/20 0.48
▸ AR P10275 3/20 0.47
▸ BTK Q06187 1/20 0.43
▸ BRD9 Q9H8M2 1/20 0.42
▸ IKZF1 Q13422 1/20 0.42
▸ IKZF2 Q9UKS7 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ OPRM1 P35372 1/20 0.41
▸ IKZF3 Q9UKT9 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL28795113 0.99 CRBN (0.56) CRBNDDB1ARBTKBRD9
SCHEMBL29803017 0.99 CRBN (0.56) CRBNDDB1ARBTKBRD9
SCHEMBL28795226 0.96 CRBN (0.52) CRBNDDB1ARBTKIKZF1
SCHEMBL28795307 0.95 CRBN (0.51) CRBNDDB1ARBTKIKZF1
SCHEMBL28795225 0.95 CRBN (0.53) CRBNDDB1ARBTKBRD9
SCHEMBL28795285 0.94 CRBN (0.50) CRBNDDB1ARBTKBRD9
SCHEMBL28795213 0.93 CRBN (0.49) CRBNDDB1ARBTKBRD9
SCHEMBL28795224 0.91 CDK9 (0.51) CRBNDDB1ARBTKBRD9
SCHEMBL28795197 0.91 CRBN (0.47) CRBNDDB1ARBTKBRD9
SCHEMBL28795420 0.90 CRBN (0.49) CRBNDDB1ARBTKBRD9

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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