SCHEMBL30451691

SCHEMBL30451691

CN(C)C(=O)c1ccc(OCCC2CC3(CCN(C(=O)C(C)(C)c4ccccc4)CC3)C2)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 14/20 0.44
▸ NR1H2 P55055 2/20 0.41
▸ NR1H3 Q13133 2/20 0.41
▸ HSD11B1 P28845 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.41
▸ OPRD1 P41143 1/20 0.39
▸ CNR1 P21554 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
SCHEMBL20061039 1.00 GPR119 (0.44) GPR119NR1H2NR1H3HSD11B1HRH3
SCHEMBL30450977 0.92 NR1H2 (0.42) GPR119NR1H2NR1H3HSD11B1HRH3
SCHEMBL20061018 0.92 NR1H2 (0.42) GPR119NR1H2NR1H3HSD11B1HRH3
SCHEMBL30452109 0.89 NR1H2 (0.56) GPR119NR1H2NR1H3HRH3
SCHEMBL22311400 0.89 NR1H2 (0.56) GPR119NR1H2NR1H3HRH3
SCHEMBL20061074 0.89 NR1H2 (0.56) GPR119NR1H2NR1H3HRH3
SCHEMBL20060939 0.89 GPR119 (0.51) GPR119HSD11B1CNR1
SCHEMBL22311075 0.85 NR1H2 (0.55) GPR119NR1H2NR1H3
SCHEMBL20061043 0.85 NR1H2 (0.55) GPR119NR1H2NR1H3
SCHEMBL30451102 0.85 NR1H2 (0.55) GPR119NR1H2NR1H3

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-3526196-B1 ARYL AND HETEROARYL ETHER DERIVATIVES AS LIVER X RECEPTOR BETA AGONISTS MERCK SHARP & DOHME LLC (US) 2026-03-18 — — EP disclosed
US-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use MERCK SHARP & DOHME LLC (US) 2023-05-23 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use NR1H2, NR1H3, NR1H4 GPR119 15/4885NR1H2 1/4885NR1H3 2/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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