SCHEMBL21696556

SCHEMBL21696556

Cc1cc(CC(=O)N2CCCC2C)on1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCNE1 P24864 11/20 0.54
▸ CDK2 P24941 11/20 0.54
▸ GSK3B P49841 8/20 0.54
▸ VHL P40337 3/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ GAA P10253 1/20 0.42
▸ KMT2A Q03164 2/20 0.41
▸ POLB P06746 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
SCHEMBL21696439 1.00 CCNE1 (0.54) CCNE1CDK2GSK3BVHLSMN1; SMN2
SCHEMBL21696706 0.95 CCNE1 (0.54) CCNE1CDK2GSK3BVHLSMN1; SMN2
SCHEMBL15112607 0.87 VHL (0.55) CCNE1CDK2GSK3BVHLKMT2A
SCHEMBL21696674 0.85 VHL (0.50) CCNE1CDK2GSK3BVHLKMT2A
SCHEMBL15126220 0.85 VHL (0.53) CCNE1CDK2GSK3BVHLHPGD
SCHEMBL21697138 0.84 CCNE1 (0.47) CCNE1CDK2GSK3BVHL
SCHEMBL13570435 0.84 VHL (0.52) CCNE1CDK2GSK3BVHL
SCHEMBL21696738 0.84 VHL (0.52) CCNE1CDK2GSK3BVHL
SCHEMBL26241389 0.82 VHL (0.53) CCNE1CDK2GSK3BVHL
SCHEMBL21696618 0.82 VHL (0.53) CCNE1CDK2GSK3BVHLSMN1; SMN2

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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