SCHEMBL31436608

SCHEMBL31436608

CCOC(=O)C1(c2ccc(F)c(F)c2)C(C)N(C)C1C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 8/20 0.41
▸ ALDH1A1 P00352 2/20 0.39
▸ CCR2 P41597 1/20 0.36
▸ OPRK1 P41145 3/20 0.36
▸ OPRD1 P41143 2/20 0.36
▸ SLC22A1 O15245 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ ADRA1A P35348 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36

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
SCHEMBL26637720 1.00 OPRM1 (0.41) OPRM1ALDH1A1CCR2OPRK1OPRD1
SCHEMBL26637740 0.84 CHRNA1 (0.39) OPRM1ALDH1A1CCR2
SCHEMBL26637741 0.83 LMNA (0.41) OPRM1ALDH1A1OPRK1OPRD1SLC22A1
SCHEMBL31436667 0.83 LMNA (0.41) OPRM1ALDH1A1OPRK1OPRD1SLC22A1
SCHEMBL26637713 0.77 CCR2 (0.37) ALDH1A1CCR2SLC6A4KCNH2
SCHEMBL26637850 0.75 ALDH1A1 (0.39) OPRM1ALDH1A1CCR2OPRK1OPRD1
SCHEMBL31436670 0.75 ALDH1A1 (0.39) OPRM1ALDH1A1CCR2OPRK1OPRD1
SCHEMBL26637710 0.75 OPRM1 (0.54) OPRM1OPRK1OPRD1SLC22A1SLC6A4
SCHEMBL31436663 0.75 OPRM1 (0.54) OPRM1OPRK1OPRD1SLC22A1SLC6A4
SCHEMBL28202864 0.73 OPRM1 (0.56) OPRM1OPRK1OPRD1SLC22A1SLC6A4

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
CN-119486999-A Azetidine compounds, pharmaceutical compositions thereof, methods of preparation and their use in the treatment of CNS disorders 伊科诺姆有限公司 2025-02-18 — — CN claimed
CN-119486999-A Azetidine compounds, pharmaceutical compositions thereof, methods of preparation and their use in the treatment of CNS disorders 伊科诺姆有限公司 2025-02-18 — — CN disclosed
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