SCHEMBL27426698

SCHEMBL27426698

CC(=O)N1CCSCC1C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.39
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MMP2 P08253 1/20 0.31
ANPEP P15144 1/20 0.31
ATM Q13315 1/20 0.31
POLB P06746 1/20 0.30

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
SCHEMBL16350242 0.85 KDM4E (0.33) KDM4EALDH1A1HPGDCASP1CASP7
SCHEMBL10215588 0.77 HSD17B10 (0.40) CNR2HSD17B10ATM
SCHEMBL4721124 0.74 SMN1; SMN2 (0.36) MMP2ANPEPATMPOLB
SCHEMBL606217 0.71 F2 (0.44)
SCHEMBL608859 0.71 F2 (0.44)
SCHEMBL642427 0.71 F2 (0.44)
SCHEMBL14843311 0.70 CNR2 (0.32) CNR2
SCHEMBL17327535 0.69 CHRM2 (0.42)
SCHEMBL642472 0.69 CHRM2 (0.42)
SCHEMBL10865220 0.69 ACE (0.40) ATM

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-2024137813-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION PRETZEL THERAPEUTICS, INC. (US) 2024-06-27 WO disclosed