SCHEMBL31013849

SCHEMBL31013849

CN1CCC(Oc2cc(Br)c3c(c2)CN(C(=O)OC(C)(C)C)C3)CC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 8/20 0.45
▸ HRH3 Q9Y5N1 1/20 0.42
▸ NR1H2 P55055 1/20 0.41
▸ PDE4B Q07343 3/20 0.40
▸ PDE4A P27815 2/20 0.40
▸ PDE4C Q08493 2/20 0.40
▸ PDE4D Q08499 2/20 0.40
▸ ESR2 Q92731 1/20 0.39
▸ DDB1 Q16531 1/20 0.38
▸ CRBN Q96SW2 1/20 0.38
▸ PIK3CD O00329 1/20 0.38
▸ CHEK2 O96017 1/20 0.38

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
SCHEMBL24914051 0.92 NR1H2 (0.47) GPR119HRH3NR1H2PDE4BPDE4A
SCHEMBL30156685 0.92 NR1H2 (0.47) GPR119HRH3NR1H2PDE4BPDE4A
SCHEMBL30550460 0.82 HDAC1 (0.44) NR1H2ESR2DDB1CRBN
SCHEMBL29069135 0.82 HDAC1 (0.44) NR1H2ESR2DDB1CRBN
SCHEMBL31014001 0.82 GPR119 (0.54) GPR119HRH3NR1H2ESR2DDB1
SCHEMBL31014023 0.79 HRH3 (0.40) GPR119HRH3NR1H2PDE4BPDE4A
SCHEMBL31014014 0.79 HRH3 (0.40) GPR119HRH3NR1H2PDE4BPDE4A
SCHEMBL31014052 0.78 GPR119 (0.50) GPR119HRH3NR1H2ESR2DDB1
SCHEMBL31013933 0.78 GPR119 (0.50) GPR119HRH3NR1H2ESR2DDB1
SCHEMBL19358156 0.78 NR1H2 (0.54) NR1H2ESR2DDB1CRBN

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
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