SCHEMBL5779865

SCHEMBL5779865

CC1CCC(C2CCCC2)C1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.33
TRPA1 O75762 2/20 0.31
TRPM8 Q7Z2W7 2/20 0.31
ALOX5 P09917 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
SCHEMBL17800105 1.00 ALDH1A1 (0.47) ALDH1A1L3MBTL1TRPA1TRPM8ALOX5
SCHEMBL9441857 1.00 ALDH1A1 (0.47) ALDH1A1L3MBTL1TRPA1TRPM8ALOX5
SCHEMBL2252062 1.00 ALDH1A1 (0.47) ALDH1A1L3MBTL1TRPA1TRPM8ALOX5
SCHEMBL8024177 0.97 ALDH1A1 (0.44) ALDH1A1L3MBTL1TRPA1TRPM8
SCHEMBL4764671 0.94 ALDH1A1 (0.39) ALDH1A1L3MBTL1TRPA1TRPM8
SCHEMBL27114563 0.88 ALDH1A1 (0.47) ALDH1A1
SCHEMBL14230816 0.87 L3MBTL1 (0.39) L3MBTL1TRPA1TRPM8
SCHEMBL7553320 0.87 L3MBTL1 (0.39) L3MBTL1TRPA1TRPM8
SCHEMBL11401966 0.87 L3MBTL1 (0.39) L3MBTL1TRPA1TRPM8
SCHEMBL9802737 0.86 ALDH1A1 (0.44) ALDH1A1

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
US-20060293297-A1 Cyanofluoropyrrolidine derviative TAISHO PHARMACEUTICAL CO., LTD. (JP) 2006-12-28 US disclosed
EP-1627870-A1 CYANOFLUOROPYRROLIDINE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD (JP) 2006-02-22 EP 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-20060293297-A1 Cyanofluoropyrrolidine derviative DPP4, DPP3, NPY4R ALDH1A1 3197/4885L3MBTL1 1208/4885TRPA1 2183/4885

“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.