SCHEMBL21696706

SCHEMBL21696706

Cc1cc(CC(=O)N2CCCCCC2C)on1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 5/20 0.54
▸ CDK2 P24941 5/20 0.54
▸ GSK3B P49841 4/20 0.54
▸ HPGD P15428 3/20 0.50
▸ VHL P40337 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ GAA P10253 3/20 0.46
▸ KMT2A Q03164 1/20 0.44
▸ TP53 P04637 1/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ HTT P42858 1/20 0.42

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
SCHEMBL21696439 0.95 CCNE1 (0.54) CCNE1CDK2GSK3BHPGDVHL
SCHEMBL21696556 0.95 CCNE1 (0.54) CCNE1CDK2GSK3BHPGDVHL
SCHEMBL15112607 0.82 VHL (0.55) CCNE1CDK2GSK3BVHLKMT2A
SCHEMBL21696674 0.80 VHL (0.50) CCNE1CDK2GSK3BVHLKMT2A
SCHEMBL26241389 0.80 VHL (0.53) CCNE1CDK2GSK3BVHLRAB9A
SCHEMBL15126220 0.80 VHL (0.53) CCNE1CDK2GSK3BHPGDVHL
SCHEMBL21697138 0.80 CCNE1 (0.47) CCNE1CDK2GSK3BVHL
SCHEMBL13570435 0.79 VHL (0.52) CCNE1CDK2GSK3BVHL
SCHEMBL21696738 0.79 VHL (0.52) CCNE1CDK2GSK3BVHL
SCHEMBL20012510 0.78 VHL (0.51) CCNE1CDK2GSK3BVHL

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-3608317-A1 COMPOUNDS & METHODS FOR THE ENHANCED DEGRADATION OF TARGETED PROTEINS & OTHER POLYPEPTIDES BY AN E3 UBIQUITIN LIGASE Yale University (US) 2020-02-12 — — EP disclosed
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