SCHEMBL24529153

SCHEMBL24529153

N#CCCC(N)C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
SLC1A2 P43004 1/20 0.36
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LOX P28300 1/20 0.33
LOXL3 P58215 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33

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
SCHEMBL24529151 1.00 TSHR (0.37) TSHRSLC1A2ALDH1A1TDP1LOX
SCHEMBL18996844 0.88 TSHR (0.35) TSHRSLC1A2ALDH1A1TDP1LOX
SCHEMBL20919216 0.74
SCHEMBL5220284 0.74 TSHR (0.40) TSHRSLC1A2ALDH1A1TDP1LOX
SCHEMBL4918992 0.71 TSHR (0.34) TSHRSLC1A2ALDH1A1TDP1LOX
SCHEMBL4288456 0.70 TSHR (0.48) TSHRALDH1A1TDP1
SCHEMBL27969711 0.69 TSHR (0.46) TSHRSLC1A2ALDH1A1TDP1LOX
SCHEMBL6608456 0.69 TSHR (0.46) TSHRSLC1A2ALDH1A1TDP1LOX
SCHEMBL31266480 0.68 TSHR (0.41) TSHRALDH1A1TDP1
SCHEMBL24529143 0.67 KIF11 (0.34)

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 TSHR 197/4885SLC1A2 211/4885ALDH1A1 2124/4885

“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.