SCHEMBL31013952

SCHEMBL31013952

CN(C)CCOc1cc(C=O)c2c(c1)CCN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 1/20 0.43
▸ NR1H2 P55055 1/20 0.43
▸ MGLL Q99685 1/20 0.41
▸ ABHD6 Q9BV23 1/20 0.41
▸ GPR119 Q8TDV5 9/20 0.40
▸ MAPT P10636 2/20 0.37
▸ PDE10A Q9Y233 1/20 0.36
▸ MTHFD2 P13995 1/20 0.36
▸ HSP90B1 P14625 1/20 0.35
▸ TRAP1 Q12931 1/20 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
SCHEMBL31014042 0.91 ESR2 (0.43) ESR2NR1H2MGLLABHD6GPR119
SCHEMBL24913916 0.86 ESR2 (0.45) ESR2NR1H2MGLLABHD6GPR119
SCHEMBL30156757 0.86 ESR2 (0.45) ESR2NR1H2MGLLABHD6GPR119
SCHEMBL31014030 0.84 ESR2 (0.43) ESR2NR1H2MGLLABHD6GPR119
SCHEMBL31013916 0.83 MGLL (0.45) ESR2NR1H2MGLLABHD6GPR119
SCHEMBL31014031 0.80 ESR2 (0.62) ESR2NR1H2MGLLABHD6GPR119
SCHEMBL31013888 0.80 NR1H2 (0.61) ESR2NR1H2MGLLABHD6GPR119
SCHEMBL31013911 0.80 GPR119 (0.41) ESR2NR1H2MGLLABHD6GPR119
SCHEMBL31013971 0.77 MGLL (0.48) ESR2NR1H2MGLLABHD6GPR119
SCHEMBL5100452 0.76 ESR2 (0.60) ESR2NR1H2MGLLABHD6GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4651955-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2025-11-26 — — EP disclosed
WO-2024153947-A1 INHIBITOR COMPOUNDS Neophore Limited (GB) 2024-07-25 — — WO disclosed
Send feedback