SCHEMBL30452059

SCHEMBL30452059

O=C(N[C@H]1CCOC1)c1ccc(OCCCCC2CCN(C(=O)[C@](O)(c3ccccc3)C(F)(F)F)CC2)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 2/20 0.42
▸ NR1H3 Q13133 2/20 0.42
▸ RAB9A P51151 1/20 0.41
▸ GPR119 Q8TDV5 2/20 0.39
▸ BTK Q06187 2/20 0.37
▸ GPR52 Q9Y2T5 4/20 0.36
▸ SLC6A12 P48065 1/20 0.35
▸ PTGIR P43119 1/20 0.35
▸ NTRK1 P04629 2/20 0.35
▸ THRB P10828 1/20 0.34

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
SCHEMBL22311052 1.00 NR1H2 (0.42) NR1H2NR1H3RAB9AGPR119BTK
SCHEMBL22310611 1.00 NR1H2 (0.42) NR1H2NR1H3RAB9AGPR119BTK
SCHEMBL22284448 0.92 NR1H2 (0.46) NR1H2NR1H3GPR119SLC6A12NTRK1
SCHEMBL30451172 0.92 NR1H2 (0.46) NR1H2NR1H3GPR119SLC6A12NTRK1
SCHEMBL22284450 0.92 NR1H2 (0.46) NR1H2NR1H3GPR119SLC6A12NTRK1
SCHEMBL22311278 0.92 NR1H2 (0.46) NR1H2NR1H3GPR119SLC6A12NTRK1
SCHEMBL20060882 0.85 GPR119 (0.39) RAB9AGPR119BTKSLC6A12NTRK1
SCHEMBL20068717 0.85 NR1H2 (0.50) NR1H2NR1H3GPR119THRB
SCHEMBL22284380 0.85 NR1H2 (0.50) NR1H2NR1H3GPR119THRB
SCHEMBL20060903 0.85 NR1H2 (0.50) NR1H2NR1H3GPR119THRB

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 NR1H2 1/4885NR1H3 2/4885RAB9A 1812/4885

“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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