SCHEMBL24370554

SCHEMBL24370554

CCCCCCCCCCOC(=O)C1CCC(C(C)C)CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 1/20 0.47
▸ PPARG P37231 3/20 0.42
▸ EPHX1 P07099 1/20 0.41
▸ TSHR P16473 3/20 0.40
▸ EPHX2 P34913 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ GAA P10253 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ CES2 O00748 1/20 0.39
▸ HCAR2 Q8TDS4 1/20 0.38
▸ RAD52 P43351 1/20 0.38
▸ NPSR1 Q6W5P4 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
SCHEMBL27524359 1.00 NAAA (0.47) NAAAPPARGEPHX1TSHREPHX2
SCHEMBL12584054 0.94 ALDH1A1 (0.41) NAAAPPARGTSHREPHX2HCAR2
SCHEMBL17049674 0.94 ALDH1A1 (0.41) NAAAPPARGTSHREPHX2HCAR2
SCHEMBL1297108 0.88 NAAA (0.59) NAAAPPARGEPHX1TSHREPHX2
SCHEMBL1297175 0.88 NAAA (0.59) NAAAPPARGEPHX1TSHREPHX2
SCHEMBL19348900 0.88 NAAA (0.59) NAAAPPARGEPHX1TSHREPHX2
SCHEMBL11833028 0.88 NAAA (0.59) NAAAPPARGEPHX1TSHREPHX2
SCHEMBL1296605 0.88 NAAA (0.59) NAAAPPARGEPHX1TSHREPHX2
SCHEMBL11823716 0.88 NAAA (0.59) NAAAPPARGEPHX1TSHREPHX2
SCHEMBL1296550 0.88 NAAA (0.59) NAAAPPARGEPHX1TSHREPHX2

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
US-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-28 — — US disclosed
US-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-28 — — US disclosed
WO-2022084741-A1 CFTR MODULATOR COMPOUNDS, COMPOSITIONS, AND USES THEREOF ILDONG PHARMACEUTICAL CO., LTD. (KR) 2022-04-28 — — 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-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators PDE4A, PDE4B, PDE5A NAAA 2171/4885PPARG 647/4885EPHX1 910/4885

“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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