SCHEMBL17049674

SCHEMBL17049674

CCCCOC(=O)C1CCC(C(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.41
▸ ATM Q13315 1/20 0.39
▸ NAAA Q02083 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ PPM1B O75688 1/20 0.36
▸ PTPN1 P18031 1/20 0.36
▸ PPP1CC P36873 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ HCAR2 Q8TDS4 1/20 0.35
▸ PPARG P37231 1/20 0.35

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
SCHEMBL12584054 1.00 ALDH1A1 (0.41) ALDH1A1ATMNAAAHPGDTSHR
SCHEMBL27524359 0.94 NAAA (0.47) NAAATSHREPHX2HCAR2PPARG
SCHEMBL24370554 0.94 NAAA (0.47) NAAATSHREPHX2HCAR2PPARG
SCHEMBL24370556 0.90 PPM1B (0.45) ALDH1A1PPM1BPTPN1PPP1CCMAPT
SCHEMBL16750979 0.89 ALDH1A1 (0.40) ALDH1A1ATMNAAAHPGDTSHR
SCHEMBL10291085 0.89 ALDH1A1 (0.40) ALDH1A1ATMNAAAHPGDTSHR
SCHEMBL552606 0.88 ALDH1A1 (0.52) ALDH1A1ATMNAAAHPGDTSHR
SCHEMBL812979 0.88 ALDH1A1 (0.52) ALDH1A1ATMNAAAHPGDTSHR
SCHEMBL526157 0.88 ALDH1A1 (0.52) ALDH1A1ATMNAAAHPGDTSHR
SCHEMBL813357 0.88 ALDH1A1 (0.52) ALDH1A1ATMNAAAHPGDTSHR

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 4 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
US-9120785-B2 Pyridyl aminopyridines as Syk inhibitors MERCK SHARP & DOHME CORP. (US) 2015-09-01 — — 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-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators PDE4A, PDE4B, PDE5A ALDH1A1 983/4885ATM 1018/4885NAAA 2171/4885

“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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