SCHEMBL29913655

SCHEMBL29913655

O=C1CC[C@H](NC(=O)c2cnccn2)C(=O)N1

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 16/20 0.69
DDB1 Q16531 5/20 0.54
IKZF3 Q9UKT9 1/20 0.52
BRD4 O60885 2/20 0.49
PABPC1 P11940 1/20 0.48
SMYD3 Q9H7B4 1/20 0.46
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL20128671 1.00 CRBN (0.69) CRBNDDB1IKZF3BRD4PABPC1
SCHEMBL29568563 0.82 CRBN (1.00) CRBNDDB1IKZF3BRD4SMYD3
SCHEMBL20128668 0.82 CRBN (1.00) CRBNDDB1IKZF3BRD4SMYD3
SCHEMBL30760758 0.82 CRBN (1.00) CRBNDDB1IKZF3BRD4SMYD3
SCHEMBL30066328 0.82 CRBN (1.00) CRBNDDB1IKZF3BRD4SMYD3
SCHEMBL20128679 0.81 CRBN (0.71) CRBNDDB1IKZF3BRD4
SCHEMBL2241239 0.80 RAB9A (0.49) CRBNSMYD3
SCHEMBL10069143 0.80 RAB9A (0.49) CRBNSMYD3
SCHEMBL23799194 0.79 CRBN (0.72) CRBNDDB1IKZF3BRD4
SCHEMBL20812186 0.79 CRBN (0.68) CRBNDDB1IKZF3BRD4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118638043-A Compounds and methods for targeted degradation of androgen receptor 阿尔维纳斯运营股份有限公司 2024-09-13 CN disclosed
CN-118059104-A Compounds and methods for targeted degradation of androgen receptor 阿尔维纳斯运营股份有限公司 2024-05-24 CN disclosed
CN-115175901-B Compounds and methods for targeted degradation of androgen receptor 阿尔维纳斯运营股份有限公司 2024-03-22 CN disclosed
EP-4077309-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas Operations, Inc. (US) 2022-10-26 EP disclosed
CN-115175901-A Compounds and methods for targeted degradation of androgen receptor 阿尔维纳斯运营股份有限公司 2022-10-11 CN disclosed