SCHEMBL21696748

SCHEMBL21696748

Cc1nc(CC(=O)N2CCCC2C(=O)NCc2ccc(Cl)cc2)no1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.49
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ PKM P14618 2/20 0.48
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ MAPT P10636 2/20 0.48
▸ F2 P00734 3/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.44
▸ USP2 O75604 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL15126131 0.84 VHL (0.50) POLBMEN1KMT2AMAPTALDH1A1
SCHEMBL15125915 0.84 VHL (0.59) MAPT
SCHEMBL21696687 0.83 VHL (0.59) POLBMEN1KMT2APKMCYP3A4
SCHEMBL15126261 0.83 VHL (0.59) POLBMEN1KMT2APKMCYP3A4
SCHEMBL16277211 0.81 VHL (0.57) POLBMEN1KMT2APKMCYP3A4
SCHEMBL21697275 0.79 POLB (0.49) POLBMEN1KMT2APKMCYP3A4
SCHEMBL16277175 0.79 POLB (0.51) POLBMEN1KMT2APKMCYP3A4
SCHEMBL22291794 0.78 POLB (0.52) POLBMEN1KMT2APKMCYP3A4
SCHEMBL21696530 0.78 CYP3A4 (0.59) POLBMEN1KMT2APKMCYP3A4
SCHEMBL16277225 0.77 POLB (0.51) POLBMEN1KMT2APKMCYP3A4

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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