SCHEMBL2422889

SCHEMBL2422889

CCC(C)CC1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.42
CYP1A2 P05177 1/20 0.41
CTSK P43235 5/20 0.36
CTSL P07711 2/20 0.36
CTSB P07858 2/20 0.36
ATM Q13315 1/20 0.36
CPB2 Q96IY4 1/20 0.33

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
SCHEMBL16411251 0.97 SHBG (0.39) SHBGCYP1A2CTSKCTSLCTSB
SCHEMBL3155857 0.87 CYP1A2 (0.40) SHBGCYP1A2CTSKCTSLCTSB
SCHEMBL5655242 0.87
SCHEMBL4655208 0.85 CYP1A2 (0.39) SHBGCYP1A2CTSKCTSLCTSB
SCHEMBL4655235 0.82 CYP1A2 (0.35) SHBGCYP1A2CTSKCTSLCTSB
SCHEMBL7087843 0.82 CYP1A2 (0.37) SHBGCYP1A2CTSKCTSLCTSB
SCHEMBL28098164 0.81 CYP1A2 (0.43) SHBGCYP1A2CTSKCTSLCTSB
SCHEMBL19003120 0.78 CYP1A2 (0.34) CYP1A2CTSKCTSLCTSB
SCHEMBL9293825 0.78 EPHX1 (0.41)
SCHEMBL1903005 0.78 CYP1A2 (0.34) CYP1A2CTSKCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025224341-A1 PROCESS FOR PRODUCING A JET FUEL FROM LIGNIN OIL TOTALENERGIES ONETECH (FR) 2025-10-30 WO disclosed
WO-2025224331-A1 NICKEL PHOSPHORUS CATALYSTS FOR HYDROPROCESSING TOTALENERGIES ONETECH (FR) 2025-10-30 WO disclosed
EP-4640794-A1 METHOD FOR PREPARING JET FUEL FROM LIGNIN OIL TotalEnergies OneTech (FR) 2025-10-29 EP disclosed
EP-3556783-A1 RESIN, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN Sumitomo Chemical Company, Limited (JP) 2019-10-23 EP disclosed
EP-2722323-B1 Process for the preparation of 2-methyl-4-phenyl-2-pentanol BASF SE (DE) 2018-11-28 EP disclosed
EP-2755938-B1 METHOD FOR PRODUCING 4-CYCLOHEXYL-2-METHYL-2-BUTANOL BASF SE (DE) 2017-03-01 EP disclosed
CN-106187685-A The method preparing 4 cyclohexyl 2 methyl 2 butanol 巴斯夫欧洲公司 2016-12-07 CN disclosed
US-20160311741-A1 PROCESS FOR PREPARING 4-CYCLOHEXYL-2-METHYL-2-BUTANOL BASF SE (DE) 2016-10-27 US disclosed
CN-105967975-A Process for the preparation of 4-cyclohexyl-2-methyl-2-butanol 巴斯夫欧洲公司 2016-09-28 CN disclosed
CN-103796980-B Process for preparing 4-cyclohexyl-2-methyl-2-butanol 巴斯夫欧洲公司 2016-08-31 CN disclosed
WO-2011117360-A2 PROCESS FOR THE PREPARATION OF 4-CYCLOHEXYL-2-METHYL-2-BUTANOL BASF SE (DE) 2011-09-29 WO disclosed
US-20110237684-A1 Process for preparing 4-cyclohexyl-2-methyl-2-butanol BASF SE (DE) 2011-09-29 US disclosed
EP-0384693-B1 Foamable polymer composition and foamed article MITSUI PETROCHEMICAL IND (JP) 1997-11-19 EP disclosed
EP-0386896-B1 Thermoplastic resin composition MITSUI PETROCHEMICAL IND (JP) 1995-01-25 EP disclosed
EP-0532693-A1 1,4-DIAMINO-2,3-DIHYDROXYBUTANES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1993-03-24 EP disclosed
US-5154753-A Cyclohexenone derivatives, their preparation and their use as herbicides and plant growth regulators BASF AKTIENGESELLSCHAFT (DE) 1992-10-13 US disclosed
WO-1992009609-A1 HIGH PURITY ALKYLLITHIUM COMPOUNDS AND PROCESS OF PREPARATION FMC CORPORATION (US) 1992-06-11 WO disclosed
US-4990559-A Thermoplastic resin composition MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-02-05 US disclosed
EP-0233267-A1 SMECTIC CRYSTAL PHASES. MERCK PATENT GMBH (DE) 1987-08-26 EP disclosed
WO-1987001717-A2 SMECTIC CYSTAL PHASES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1987-03-26 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 (2 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-20110237684-A1 Process for preparing 4-cyclohexyl-2-methyl-2-butanol CYP4B1, HPD, ADH1C SHBG 4537/4885CYP1A2 50/4885CTSK 4377/4885
US-20160311741-A1 PROCESS FOR PREPARING 4-CYCLOHEXYL-2-METHYL-2-BUTANOL ADH1C, CYP4B1, ADH1A SHBG 4338/4885CYP1A2 82/4885CTSK 4576/4885

“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.