SCHEMBL24529414

SCHEMBL24529414

CC[C@H](CCC(F)(F)F)NC(=O)N(CC)[C@H](C)c1cc(Br)c2c(c1)CCO2

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 2/20 0.35
▸ TAS1R1 Q7RTX1 2/20 0.35
▸ HCRTR2 O43614 3/20 0.35
▸ REN P00797 2/20 0.32
▸ CHRM5 P08912 1/20 0.31

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
SCHEMBL27180999 1.00 TAS1R3 (0.35) TAS1R3TAS1R1HCRTR2RENCHRM5
SCHEMBL29723793 1.00 TAS1R3 (0.35) TAS1R3TAS1R1HCRTR2RENCHRM5
SCHEMBL27181002 1.00 TAS1R3 (0.35) TAS1R3TAS1R1HCRTR2RENCHRM5
SCHEMBL27180826 0.78 HCRTR2 (0.56) HCRTR2
SCHEMBL24529505 0.78 HCRTR2 (0.56) HCRTR2
SCHEMBL27180825 0.78 HCRTR2 (0.56) HCRTR2
SCHEMBL27180728 0.77 HCRTR2 (0.48) TAS1R3TAS1R1HCRTR2
SCHEMBL24529397 0.77 HCRTR2 (0.48) TAS1R3TAS1R1HCRTR2
SCHEMBL27180730 0.77 HCRTR2 (0.48) TAS1R3TAS1R1HCRTR2
SCHEMBL24529384 0.67 HCRTR2 (0.43) HCRTR2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4262788-B1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2026-01-21 — — EP disclosed
US-20240101555-A1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME LLC (US) 2024-03-28 — — US disclosed
WO-2022132696-A1 UREA OREXIN RECEPTOR AGONISTS MERCK SHARP & DOHME CORP. (US) 2022-06-23 — — WO 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-20240101555-A1 UREA OREXIN RECEPTOR AGONISTS HCRTR1, HCRTR2, UTS2R TAS1R3 1013/4885TAS1R1 1063/4885HCRTR2 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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