SCHEMBL21696701

SCHEMBL21696701

Cc1cc(CC(=O)N2CCCC2C(=O)NCc2ccc(-c3cncs3)cc2)on1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ VHL P40337 11/20 0.57
▸ ELOC Q15369 3/20 0.57
▸ ELOB Q15370 3/20 0.57
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ USP2 O75604 1/20 0.42
▸ NPC1 O15118 1/20 0.41
▸ F2 P00734 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40

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
SCHEMBL21697230 1.00 VHL (0.57) VHLELOCELOBCYP3A4CYP2C9
SCHEMBL16277209 0.87 VHL (0.57) VHLELOCELOBCYP3A4CYP2C9
SCHEMBL21697218 0.86 VHL (0.56) VHLELOCELOBCYP3A4CYP2C9
SCHEMBL15125931 0.86 VHL (0.76) VHLELOCELOB
SCHEMBL25769085 0.86 VHL (0.76) VHLELOCELOB
SCHEMBL21697292 0.86 VHL (0.76) VHLELOCELOB
SCHEMBL21696667 0.86 PKM (0.58) VHLELOCELOBCYP3A4CYP2C9
SCHEMBL16277211 0.85 VHL (0.57) VHLELOCELOBCYP3A4CYP2C9
SCHEMBL25769161 0.85 VHL (0.43) VHLELOCELOB
SCHEMBL21696896 0.85 VHL (0.76) VHLELOCELOBCYP3A4CYP2C9

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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