SCHEMBL31413054

SCHEMBL31413054

CC(C)(C)OC(=O)N1CCc2cc(C#N)c(F)cc2C1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 1/20 0.56
▸ NR1H2 P55055 1/20 0.55
▸ GPR119 Q8TDV5 7/20 0.48
▸ MAP3K5 Q99683 1/20 0.43
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ JAK2 O60674 1/20 0.40
▸ JAK1 P23458 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ ADORA1 P30542 1/20 0.39
▸ TRPA1 O75762 1/20 0.39

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
SCHEMBL30474184 1.00 ESR2 (0.56) ESR2NR1H2GPR119MAP3K5MEN1
SCHEMBL17221588 0.91 GPR119 (0.49) ESR2NR1H2GPR119MEN1KMT2A
SCHEMBL5599594 0.91 ESR2 (0.62) ESR2NR1H2GPR119MEN1KMT2A
SCHEMBL29516101 0.86 NR1H2 (0.61) ESR2NR1H2GPR119MEN1KMT2A
SCHEMBL19513096 0.84 ESR2 (0.55) ESR2NR1H2GPR119MAP3K5JAK2
SCHEMBL23684302 0.83 ESR2 (0.64) ESR2NR1H2MAP3K5MAPK1MAPT
SCHEMBL30199587 0.83 ESR2 (0.64) ESR2NR1H2MAP3K5MAPK1MAPT
SCHEMBL21470912 0.83 ESR2 (0.64) ESR2NR1H2MAP3K5MAPK1MAPT
SCHEMBL30260152 0.83 ESR2 (0.64) ESR2NR1H2MAP3K5MAPK1MAPT
SCHEMBL4171400 0.81 NR1H2 (0.65) ESR2NR1H2MAP3K5MAPK1MAPT

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-119343339-A Heterocyclic GLP-1 agonists 加舒布鲁姆生物公司 2025-01-21 — — CN disclosed
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