SCHEMBL6409534

SCHEMBL6409534

CC(C)(C)OC(=O)C1CC1COCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.43
PPARA Q07869 2/20 0.43
FFAR4 Q5NUL3 2/20 0.42
AGTR2 P50052 1/20 0.41
CTSS P25774 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.39
PPARG P37231 1/20 0.39
KLK7 P49862 1/20 0.39
KLK5 Q9Y337 1/20 0.39
LIPE Q05469 1/20 0.38
ALDH1A1 P00352 2/20 0.38
CTSL P07711 1/20 0.38
LMNA P02545 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
SCHEMBL28940568 1.00 L3MBTL1 (0.43) L3MBTL1PPARAFFAR4AGTR2CTSS
SCHEMBL26951492 1.00 L3MBTL1 (0.43) L3MBTL1PPARAFFAR4AGTR2CTSS
SCHEMBL6407743 0.92 FFAR4 (0.47) PPARAFFAR4CTSSPPARG
SCHEMBL28741127 0.88 L3MBTL1 (0.46) L3MBTL1PPARAAGTR2CTSSRAB9A
SCHEMBL28741135 0.88 L3MBTL1 (0.46) L3MBTL1PPARAAGTR2CTSSRAB9A
SCHEMBL28741137 0.88 L3MBTL1 (0.46) L3MBTL1PPARAAGTR2CTSSRAB9A
SCHEMBL6409542 0.87 L3MBTL1 (0.44) L3MBTL1FFAR4RAB9AKMT2AALDH1A1
SCHEMBL6407549 0.84 CPB1 (0.51) FFAR4AGTR2ALDH1A1LMNA
SCHEMBL17407791 0.84 CPB1 (0.51) FFAR4AGTR2ALDH1A1LMNA
SCHEMBL23970542 0.82 CA1 (0.49) FFAR4AGTR2ALDH1A1

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-20050288526-A1 Process for production of 2-(hydroxymethyl)cyclo-propanecarboxylic acids SUMITOMO CHEMICAL COMPAY LIMTED (JP) 2005-12-29 US disclosed
EP-1538141-A1 PROCESS FOR PRODUCTION OF 2-(HYDROXYMETHYL)CYCLO- PROPANECARBOXYLIC ACIDS Sumitomo Chemical Company, Limited (JP) 2005-06-08 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-20050288526-A1 Process for production of 2-(hydroxymethyl)cyclo-propanecarboxylic acids GRHPR, PCCA, C5 L3MBTL1 2735/4885PPARA 2618/4885FFAR4 2429/4885

“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.