SCHEMBL24744870

SCHEMBL24744870

CC(C)(C)OC(=O)N1CC(N2CCN(CCCO)CC2)C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.46
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ACKR3 P25106 2/20 0.37
TLR8 Q9NR97 1/20 0.37
EPHX2 P34913 4/20 0.37
CHRM2 P08172 2/20 0.37
CHRM1 P11229 2/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
HPGD P15428 1/20 0.36
CHRM4 P08173 1/20 0.35
CHRM3 P20309 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
SCHEMBL27178679 0.92 NR1H2 (0.48) NR1H2USP2SMN1; SMN2ACKR3CHRM2
SCHEMBL214593 0.84 USP2 (0.49) NR1H2USP2SMN1; SMN2ACKR3TLR8
SCHEMBL24746774 0.84 NR1H2 (0.39) NR1H2USP2SMN1; SMN2ACKR3TLR8
SCHEMBL14985093 0.83 NR1H2 (0.47) NR1H2USP2SMN1; SMN2CHRM2CHRM1
SCHEMBL24744872 0.83 NR1H2 (0.38) NR1H2EPHX2
SCHEMBL31208801 0.83 NR1H2 (0.42) NR1H2USP2SMN1; SMN2MEN1ALDH1A1
SCHEMBL21302145 0.81 NR1H2 (0.46) NR1H2USP2SMN1; SMN2EPHX2CHRM2
SCHEMBL24744839 0.81 NR1H2 (0.44) NR1H2USP2SMN1; SMN2EPHX2CHRM2
SCHEMBL12193455 0.80 USP2 (0.47) NR1H2USP2SMN1; SMN2ACKR3TLR8
SCHEMBL29262052 0.80 NR1H2 (0.39) NR1H2USP2SMN1; SMN2MEN1ALDH1A1

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-2022253713-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN CAPTOR THERAPEUTICS S.A. (PL) 2022-12-08 WO disclosed