SCHEMBL29068340

SCHEMBL29068340

CC(C)(C)OC(=O)N1CCC(c2cc(Cl)cc(OC(F)C(F)F)c2)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.48
MAPT P10636 4/20 0.42
TP53 P04637 3/20 0.42
STS P08842 3/20 0.41
KDM4E B2RXH2 1/20 0.41
THRB P10828 1/20 0.41
DPP4 P27487 1/20 0.41
LMNA P02545 2/20 0.41
USP30 Q70CQ3 1/20 0.40
TRPV3 Q8NET8 1/20 0.40
CNR1 P21554 1/20 0.39
ALDH1A1 P00352 2/20 0.39
NPC1 O15118 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL826363 0.84 PDE4B (0.56) PDE4BMAPTTP53STSKDM4E
SCHEMBL21381706 0.84 PDE4B (0.56) PDE4BMAPTTP53STSKDM4E
SCHEMBL23211834 0.82 LIPE (0.46) PDE4BMAPTTP53STSKDM4E
SCHEMBL21381778 0.82 LIPE (0.46) PDE4BMAPTTP53STSKDM4E
SCHEMBL19701837 0.78 ADAM17 (0.53) PDE4BMAPTSTSKDM4ETHRB
SCHEMBL12279418 0.76 TP53 (0.60) PDE4BMAPTTP53STSKDM4E
SCHEMBL15534541 0.76 PDE4B (0.54) PDE4BMAPTTP53STSKDM4E
SCHEMBL22988918 0.75 PDE4B (0.58) PDE4BMAPTTP53STSLMNA
SCHEMBL12279642 0.75 PDE4B (0.58) PDE4BMAPTTP53STSLMNA
SCHEMBL28298497 0.75 PDE4B (0.56) PDE4BMAPTKDM4ETHRBDPP4

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