SCHEMBL29259997

SCHEMBL29259997

O=C1CCC(N2C(=O)c3ccc(N4CCN(CCN5CCNCC5)CC4)cc3C2=O)C(=O)N1

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 18/20 0.72
▸ DDB1 Q16531 10/20 0.55
▸ ALDH1A1 P00352 1/20 0.53
▸ CHRM2 P08172 1/20 0.53
▸ OPRM1 P35372 1/20 0.53
▸ IKZF3 Q9UKT9 1/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ HPGDS O60760 1/20 0.47
▸ EGFR P00533 1/20 0.47

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
SCHEMBL30144407 1.00 CRBN (0.72) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL30619732 0.96 CRBN (0.70) CRBNDDB1ALDH1A1CHRM2OPRM1
Hydrochloric Acid SCHEMBL31491158 0.95 CRBN (0.69) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL23860207 0.94 CRBN (0.64) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL30144163 0.94 CRBN (0.64) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29132305 0.91 CRBN (0.69) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29132166 0.91 CRBN (0.69) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29927344 0.91 CRBN (0.69) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29927782 0.91 CRBN (0.69) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL24735212 0.90 CRBN (0.84) CRBNDDB1ALDH1A1CHRM2OPRM1

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-118076607-A Novel PLK1 degradation inducing compounds 厄普特拉株式会社 2024-05-24 — — CN disclosed
Send feedback