SCHEMBL29277447

SCHEMBL29277447

O=CN1CC(OCc2ccc(OC(F)(F)F)cc2F)C1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.40
CTSK P43235 1/20 0.40
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
GRM2 Q14416 2/20 0.39
ENPP2 Q13822 7/20 0.38
CHRM5 P08912 1/20 0.37
ATXN2 Q99700 6/20 0.36
FFAR4 Q5NUL3 1/20 0.35
DGKA P23743 1/20 0.35
DGKZ Q13574 1/20 0.35
ALOX5AP P20292 3/20 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
SCHEMBL21723005 0.82 ENPP2 (0.43) NAAACTSKCARM1PRMT6GRM2
SCHEMBL29277450 0.81 CARM1 (0.50) NAAACTSKCARM1PRMT6GRM2
SCHEMBL20708874 0.80 NAAA (0.38) NAAACTSKCARM1PRMT6
SCHEMBL21722847 0.79 NAAA (0.44) NAAACTSKCARM1PRMT6ENPP2
SCHEMBL22462930 0.78 LIPE (0.46) GRM2ENPP2ATXN2
SCHEMBL25325640 0.76 SLC6A2 (0.43) NAAACTSKCARM1PRMT6ENPP2
SCHEMBL29277461 0.75 IDO1 (0.49) NAAA
SCHEMBL29277432 0.75 IDO1 (0.50) NAAACARM1PRMT6
SCHEMBL25326239 0.71 GPR119 (0.51) ENPP2ATXN2
SCHEMBL17769042 0.71 GPR3 (0.40) ENPP2CHRM5FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119301113-A Novel heterocyclic carbonyl cyclic compounds as MAGL inhibitors 豪夫迈·罗氏有限公司 2025-01-10 CN claimed
CN-117295726-A Heterocyclic compounds 豪夫迈·罗氏有限公司 2023-12-26 CN claimed
CN-119301113-A Novel heterocyclic carbonyl cyclic compounds as MAGL inhibitors 豪夫迈·罗氏有限公司 2025-01-10 CN disclosed
CN-117295726-A Heterocyclic compounds 豪夫迈·罗氏有限公司 2023-12-26 CN disclosed