SCHEMBL27345241

SCHEMBL27345241

COC(=O)c1ccc(N2CC[C@@H](C=O)C2)cc1C#N

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.41
USP30 Q70CQ3 5/20 0.41
KDM4E B2RXH2 3/20 0.40
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CHRM4 P08173 3/20 0.38
NR1H2 P55055 2/20 0.38
NR1H3 Q13133 2/20 0.38
NOTUM Q6P988 1/20 0.37
SIRT6 Q8N6T7 1/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PLK1 P53350 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL30680840 1.00 AR (0.41) ARUSP30KDM4EKMT2AALDH1A1
SCHEMBL24319568 0.91 KDM4E (0.42) USP30KDM4EKMT2AALDH1A1CHRM4
SCHEMBL27132331 0.86 AR (0.44) ARNOTUM
SCHEMBL26969633 0.86 AR (0.44) ARNOTUM
SCHEMBL30680830 0.84 CHRM4 (0.42) ARUSP30KDM4EKMT2AALDH1A1
SCHEMBL27345249 0.84 CHRM4 (0.42) ARUSP30KDM4EKMT2AALDH1A1
SCHEMBL27345252 0.84 CHRM4 (0.42) ARUSP30KDM4EKMT2AALDH1A1
SCHEMBL26649322 0.84 SIRT6 (0.42) ARKDM4EKMT2AALDH1A1CHRM4
SCHEMBL24207038 0.83 USP30 (0.44) ARUSP30KDM4EKMT2AALDH1A1
SCHEMBL26969675 0.83 USP30 (0.44) ARUSP30KDM4EKMT2AALDH1A1

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
WO-2023245150-A1 KAT6 TARGETING COMPOUNDS WITH UBIQUITIN LIGASE BINDING MOIETY PRELUDE THERAPEUTICS INCORPORATED (US) 2023-12-21 WO disclosed