SCHEMBL29024816

SCHEMBL29024816

C=Cc1ccc(C(F)F)c(OC2CCC3(CC2)CN(C(=O)OC(C)(C)C)C3)n1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.35
▸ GPR119 Q8TDV5 7/20 0.34
▸ PDE4B Q07343 3/20 0.34
▸ CYP11B2 P19099 1/20 0.34
▸ ACACB O00763 1/20 0.34
▸ PDE4D Q08499 2/20 0.33
▸ SCD5 Q86SK9 1/20 0.33
▸ PDE4A P27815 1/20 0.33
▸ PDE4C Q08493 1/20 0.33
▸ FAAH O00519 1/20 0.33
▸ MGLL Q99685 1/20 0.33
▸ ABHD6 Q9BV23 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ GPR183 P32249 1/20 0.33

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
SCHEMBL29497414 1.00 KDM1A (0.35) KDM1AGPR119PDE4BCYP11B2ACACB
SCHEMBL26631337 0.87 HCRTR1 (0.31) FAAHMGLLABHD6
SCHEMBL30503578 0.87 HCRTR1 (0.31) FAAHMGLLABHD6
SCHEMBL25413490 0.86 PDE4D (0.36) KDM1AGPR119PDE4BCYP11B2ACACB
SCHEMBL29427106 0.84 PDE4D (0.37) KDM1AGPR119PDE4BCYP11B2ACACB
SCHEMBL25412820 0.84 PDE4D (0.37) KDM1AGPR119PDE4BCYP11B2ACACB
SCHEMBL29426971 0.84 GPR119 (0.40) KDM1AGPR119PDE4BCYP11B2ACACB
SCHEMBL26631457 0.84 GPR119 (0.40) KDM1AGPR119PDE4BCYP11B2ACACB
SCHEMBL25411482 0.79 GPR119 (0.42) KDM1AGPR119PDE4BCYP11B2ACACB
SCHEMBL29426941 0.77 GPR119 (0.40) KDM1AGPR119PDE4BCYP11B2ACACB

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-116323557-A Cyclobutylamide monoacylglycerol lipase modulators 詹森药业有限公司 2023-06-23 — — CN disclosed
Send feedback