SCHEMBL31020127

SCHEMBL31020127

CC(C)(C)OC(=O)N1CCc2cc(S(C)(=O)=O)ccc2C1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 1/20 0.69
▸ NR1H2 P55055 1/20 0.60
▸ GPR119 Q8TDV5 17/20 0.56

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
SCHEMBL4789776 1.00 ESR2 (0.69) ESR2NR1H2GPR119
SCHEMBL21753242 0.93 ESR2 (0.59) ESR2NR1H2GPR119
SCHEMBL21753272 0.92 GPR119 (0.59) ESR2NR1H2GPR119
SCHEMBL18022672 0.90 ESR2 (0.53) ESR2NR1H2GPR119
SCHEMBL30409191 0.89 ESR2 (0.67) ESR2NR1H2GPR119
SCHEMBL31621666 0.89 ESR2 (0.67) ESR2NR1H2GPR119
SCHEMBL31621565 0.89 ESR2 (0.67) ESR2NR1H2GPR119
SCHEMBL18033553 0.84 ESR2 (0.67) ESR2NR1H2GPR119
SCHEMBL19682381 0.84 NR1H2 (0.66) ESR2NR1H2GPR119
SCHEMBL4789781 0.83 ESR2 (0.66) ESR2NR1H2GPR119

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-119948023-A Regulator containing piperidine polycyclic derivative, preparation method and application thereof 上海翰森生物医药科技有限公司 2025-05-06 — — CN disclosed
CN-118451079-A Benzopiperidine derivative modulators, methods of preparation and uses thereof 上海翰森生物医药科技有限公司 2024-08-06 — — CN disclosed
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