SCHEMBL30567979

SCHEMBL30567979

CC1CN(C(=O)OC(C)(C)C)CCC1c1ccc(C(C)(F)F)cn1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.42
RORC P51449 1/20 0.42
TACR1 P25103 1/20 0.42
GPR119 Q8TDV5 10/20 0.41
HDAC4 P56524 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HPGDS O60760 1/20 0.40
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
JAK3 P52333 1/20 0.40
LIPE Q05469 1/20 0.39

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
SCHEMBL21382064 1.00 USP30 (0.42) USP30RORCTACR1GPR119HDAC4
SCHEMBL23211885 0.88 PDK2 (0.38) RORCTACR1LIPE
SCHEMBL30366151 0.84 MEN1 (0.45) USP30GPR119
SCHEMBL30899631 0.84 MEN1 (0.45) USP30GPR119
SCHEMBL21382137 0.84 TRPV3 (0.47) GPR119HPGDS
SCHEMBL30568020 0.84 TRPV3 (0.47) GPR119HPGDS
SCHEMBL5471664 0.77 GPR119 (0.49) GPR119HPGDSLIPE
SCHEMBL21390304 0.75 MGLL (0.51)
SCHEMBL21390420 0.75 MGLL (0.51)
SCHEMBL23148883 0.75 MGLL (0.51)

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
CN-111936503-B Oxazine monoacylglycerol lipase (MAGL) inhibitors 豪夫迈·罗氏有限公司 2023-09-12 CN disclosed