SCHEMBL29427117

SCHEMBL29427117

CC(C)(C)c1ccc(O[C@@H]2CCC3(CNC3)C2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 1/20 0.44
▸ CRBN Q96SW2 1/20 0.44
▸ NPY1R P25929 1/20 0.41
▸ NPY2R P49146 1/20 0.41
▸ NPY4R P50391 1/20 0.41
▸ NPY5R Q15761 1/20 0.41
▸ MAPT P10636 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ ACACB O00763 3/20 0.33
▸ PDE3B Q13370 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ HSD17B10 Q99714 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ HTT P42858 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
SCHEMBL26631392 1.00 DDB1 (0.44) DDB1CRBNNPY1RNPY2RNPY4R
SCHEMBL25435387 0.77 ABHD6 (0.44) DDB1CRBNNPY1RNPY2RNPY4R
SCHEMBL29470001 0.75 MGLL (0.47) RAB9ANPC1KMT2AMGLL
SCHEMBL29497491 0.74 HRH1 (0.40) ALDH1A1HRH1
SCHEMBL12169265 0.74 NPY1R (0.56) DDB1CRBNNPY1RNPY2RNPY4R
SCHEMBL29427152 0.74 ABHD6 (0.47) MAPTRAB9AALDH1A1NPC1HTT
SCHEMBL26631469 0.74 ABHD6 (0.47) MAPTRAB9AALDH1A1NPC1HTT
SCHEMBL270804 0.73 HRH1 (0.59) DDB1CRBNNPY1RNPY2RNPY4R
SCHEMBL29497425 0.73 HTR2C (0.31) FAAHMGLLABHD6
SCHEMBL25412878 0.73 HTR2C (0.31) FAAHMGLLABHD6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4217062-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN Pharmaceutica NV (BE) 2023-08-02 — — EP disclosed
CN-116323557-A Cyclobutylamide monoacylglycerol lipase modulators 詹森药业有限公司 2023-06-23 — — CN disclosed
WO-2022063784-A1 CYCLOBUTYL AMIDE MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2022-03-31 — — WO disclosed
Send feedback