SCHEMBL6156682

SCHEMBL6156682

CC(CO)CC1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 8/20 0.39
CTSL P07711 5/20 0.36
CTSB P07858 5/20 0.36
CTSH P09668 4/20 0.35
LTA4H P09960 1/20 0.35
CYP1A2 P05177 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL14261875 1.00 CTSK (0.39) CTSKCTSLCTSBCTSHLTA4H
SCHEMBL12631778 1.00 CTSK (0.39) CTSKCTSLCTSBCTSHLTA4H
SCHEMBL20030485 0.98 CTSK (0.37) CTSKCTSLCTSBCTSHLTA4H
SCHEMBL27991241 0.98 CTSK (0.37) CTSKCTSLCTSBCTSHLTA4H
SCHEMBL114230 0.89 CTSK (0.35) CTSKCTSLCTSBCTSHLTA4H
SCHEMBL18125093 0.87
SCHEMBL14928915 0.87
SCHEMBL4284276 0.87
SCHEMBL3155857 0.85 CYP1A2 (0.40) CTSKCTSLCTSBCTSHLTA4H
SCHEMBL24199 0.82 CTSK (0.36) CTSKCTSLCTSBCTSHLTA4H

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1200546-B1 ESTERS AND DIESTERS OF 3-CYCLOHEXYL-2-METHYL-1-PROPANOL, PERFUMED ARTICLES CONTAINING THEM AND METHOD OF IMPARTING FRAGRANCE BUSH BOAKE ALLEN INC (US) 2005-02-02 EP claimed
EP-1200546-A4 FRAGRANCE MATERIALS BUSH BOAKE ALLEN INC (US) 2003-07-16 EP claimed
EP-1200546-A1 FRAGRANCE MATERIALS Bush Boake Allen Inc. (US) 2002-05-02 EP claimed
US-6187727-B1 USE OF 2-METHYL-3-CYCLOHEXYLPROPANOL, ESTERS THEREOF OR MIXTURES THEREOF BUSH BOAKE ALLEN, INC. 2001-02-13 US claimed
WO-2001004253-A1 FRAGRANCE MATERIALS BUSH BOAKE ALLEN INC. (US) 2001-01-18 WO claimed
US-4197318-A CYCLOHEXYL SUBSTITUTED ALKANOLS AS POTENTIATORS JOHNSON & JOHNSON (US) 1980-04-08 US claimed
US-4091090-A PENETRANT ACCELERATOR COMPRISING CYCLOHEXYL-SUBSTITUTED ALKANOLS JOHNSON & JOHNSON (US) 1978-05-23 US claimed
US-4006218-A MICROBIOCIDE JOHNSON & JOHNSON (US) 1977-02-01 US claimed
US-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use MERCK SHARP & DOHME LLC (US) 2023-05-23 US disclosed
US-9650362-B2 Inhibitors PROBIODRUG AG (DE) 2017-05-16 US disclosed
US-9505783-B2 Method of producing pyrone and pyridone derivatives SHIONOGI & CO., LTD. (JP) 2016-11-29 US disclosed
US-20160002211-A1 METHOD OF PRODUCING PYRONE AND PYRIDONE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2016-01-07 US disclosed
US-9173885-B2 Inhibitors PROBIODRUG AG (DE) 2015-11-03 US disclosed
US-20150031876-A1 METHOD FOR PRODUCING PYRONE AND PYRIDONE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2015-01-29 US disclosed
WO-2001004253-A1 FRAGRANCE MATERIALS BUSH BOAKE ALLEN INC. (US) 2001-01-18 WO disclosed
US-4474748-A ANTIBIOTICS, FUNGICIDES, ANTISEPTICS JOHNSON & JOHNSON (US) 1984-10-02 US disclosed
US-4321257-A Potentiated medicaments JOHNSON & JOHNSON (US) 1982-03-23 US disclosed
US-4197318-A CYCLOHEXYL SUBSTITUTED ALKANOLS AS POTENTIATORS JOHNSON & JOHNSON (US) 1980-04-08 US disclosed
US-4091090-A PENETRANT ACCELERATOR COMPRISING CYCLOHEXYL-SUBSTITUTED ALKANOLS JOHNSON & JOHNSON (US) 1978-05-23 US disclosed
US-4006218-A MICROBIOCIDE JOHNSON & JOHNSON (US) 1977-02-01 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 (3 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-20150031876-A1 METHOD FOR PRODUCING PYRONE AND PYRIDONE DERIVATIVES PNPO, PDXK, CYP3A5 CTSK 1584/4885CTSL 3177/4885CTSB 2108/4885
US-11655216-B2 Aryl and heteroaryl ether derivatives as liver X receptor beta agonists, compositions, and their use NR1H2, NR1H3, NR1H4 CTSK 3783/4885CTSL 3232/4885CTSB 2824/4885
US-20160002211-A1 METHOD OF PRODUCING PYRONE AND PYRIDONE DERIVATIVES PNPO, PDXK, CYP3A5 CTSK 1680/4885CTSL 3259/4885CTSB 2236/4885

“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.