SCHEMBL27345252

SCHEMBL27345252

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

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 4/20 0.42
AR P10275 1/20 0.40
USP30 Q70CQ3 4/20 0.39
KDM4E B2RXH2 2/20 0.39
KMT2A Q03164 2/20 0.38
NR1H2 P55055 2/20 0.38
NR1H3 Q13133 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.36
NOTUM Q6P988 1/20 0.36
CHRM2 P08172 2/20 0.36
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HSD17B10 Q99714 1/20 0.35
RXFP1 Q9HBX9 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
SCHEMBL30680830 1.00 CHRM4 (0.42) CHRM4ARUSP30KDM4EKMT2A
SCHEMBL27345249 1.00 CHRM4 (0.42) CHRM4ARUSP30KDM4EKMT2A
SCHEMBL24319287 0.91 KDM4E (0.41) CHRM4USP30KDM4EKMT2ANR1H2
SCHEMBL27123954 0.90 CHRM4 (0.42) CHRM4ARUSP30NOTUM
SCHEMBL26969638 0.90 CHRM4 (0.42) CHRM4ARUSP30NOTUM
SCHEMBL27345241 0.84 AR (0.41) CHRM4ARUSP30KDM4EKMT2A
SCHEMBL26648905 0.84 SIRT6 (0.41) CHRM4ARKDM4EKMT2AALDH1A1
SCHEMBL30680840 0.84 AR (0.41) CHRM4ARUSP30KDM4EKMT2A
SCHEMBL24207038 0.81 USP30 (0.44) CHRM4ARUSP30KDM4EKMT2A
SCHEMBL27345261 0.81 ALDH1A1 (0.36) USP30KDM4ENR1H2NR1H3ALDH1A1

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