SCHEMBL30438128

SCHEMBL30438128

CC(C)(C)OC(=O)N1C2CCC(C2)C1COS(C)(=O)=O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.50
CHRM1 P11229 1/20 0.50
CHRM3 P20309 1/20 0.50
PREP P48147 4/20 0.49
HSD11B1 P28845 1/20 0.43
GPR119 Q8TDV5 11/20 0.36
NR1H2 P55055 1/20 0.35
STS P08842 1/20 0.32

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
SCHEMBL15934579 1.00 CHRM2 (0.50) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL15934589 1.00 CHRM2 (0.50) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL23026384 0.84 CHRM2 (0.55) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL6838110 0.83 CHRM2 (0.57) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL907262 0.83 CHRM2 (0.57) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL17577869 0.82 CHRM2 (0.59) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL15773320 0.82 CHRM2 (0.59) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL981972 0.82 CHRM2 (0.59) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL11912368 0.82 CHRM2 (0.59) CHRM2CHRM1CHRM3PREPHSD11B1
SCHEMBL15934635 0.82 CHRM2 (0.59) CHRM2CHRM1CHRM3PREPHSD11B1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111655680-B Hormone receptor modulators for the treatment of metabolic mutations and fibrotic conditions and disorders 阿德利克斯股份有限公司 2024-03-05 CN disclosed
CN-110177783-B Hormone receptor modulators for the treatment of metabolic conditions and disorders 阿德利克斯股份有限公司 2023-06-06 CN disclosed