SCHEMBL579573

SCHEMBL579573

CC(C)(C)[C@H]1CC[C@@H](O)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.40
LIPA P38571 1/20 0.38
TSHR P16473 1/20 0.37
SHBG P04278 1/20 0.35
EPHX2 P34913 2/20 0.34
GLA P06280 1/20 0.34
HSD11B1 P28845 1/20 0.34
SLC18A3 Q16572 2/20 0.33
MAPT P10636 1/20 0.32
CYP2D6 P10635 1/20 0.32
KCNH2 Q12809 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
HTT P42858 3/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
APOBEC3A P31941 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
KDM4E B2RXH2 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL579272 1.00 EPHX1 (0.40) EPHX1LIPATSHRSHBGEPHX2
SCHEMBL114150 1.00 EPHX1 (0.40) EPHX1LIPATSHRSHBGEPHX2
SCHEMBL12158781 0.92 EPHX1 (0.36) EPHX1LIPATSHRSHBGEPHX2
SCHEMBL4846911 0.89 TSHR (0.43) EPHX1LIPATSHRSHBGEPHX2
SCHEMBL4844027 0.89 TSHR (0.50) EPHX1LIPATSHRSHBGEPHX2
Ethylene Glycol SCHEMBL14921884 0.89 LIPA (0.37) EPHX1LIPATSHRSHBGEPHX2
Alcohol SCHEMBL8162196 0.89 SHBG (0.39) EPHX1LIPATSHRSHBGEPHX2
Acetic Acid SCHEMBL1629433 0.87 EPHX1 (0.42) EPHX1LIPAEPHX2GLAHSD11B1
Acetic Acid SCHEMBL1202262 0.87 EPHX1 (0.42) EPHX1LIPAEPHX2GLAHSD11B1
1,5-Pentanediol SCHEMBL9996125 0.83 LIPA (0.34) EPHX1LIPATSHRSHBGHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12409123-B2 Compositions and methods for altering the color of hair L'OREAL (FR) 2025-09-09 US claimed
CN-119798054-B Alkyl functionalized cyclo-resveratrol hydrocarbon, preparation method thereof, capillary gas chromatographic column and application 洛阳师范学院 2025-06-13 CN claimed
CN-119837773-A Cosmetic containing 4-tert-butylcyclohexanol and ectoine 拜尔斯道夫股份有限公司 2025-04-18 CN claimed
CN-119798054-A Alkyl functionalized cyclo-resveratrol hydrocarbon, preparation method thereof, capillary gas chromatographic column and application 洛阳师范学院 2025-04-11 CN claimed
EP-4486289-A1 COMPOSITIONS AND METHODS FOR CURLY HAIR L'OREAL (FR) 2025-01-08 EP claimed
US-12144879-B2 Compositions and methods for altering the color of hair L'OREAL (FR) 2024-11-19 US claimed
US-12121606-B2 Methods and compositions for improving skin L'OREAL (FR) 2024-10-22 US claimed
US-12115239-B2 Cosmetic compositions, kits thereof, and methods for making and using the same L'OREAL (FR) 2024-10-15 US claimed
US-12109287-B2 Compositions and methods for altering the color of hair L'OREAL (FR) 2024-10-08 US claimed
CN-117902959-A Alkyl functionalized hexa-arene used for stationary phase, preparation method thereof, capillary gas chromatographic column and application thereof 沈阳工业大学 2024-04-19 CN claimed
US-9060943-B2 Compositions comprising trans-tert-butyl cyclohexanol as skin irritation-reducing agent SYMRISE AG (DE) 2015-06-23 US claimed
US-8232430-B2 Method for the preparation of cis-4-tert-butylcyclohexanol KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2012-07-31 US claimed
US-20120121737-A1 COMPOSITIONS COMPRISING TRANS-TERT-BUTYL CYCLOHEXANOL AS SKIN IRRITATION-REDUCING AGENT SYMRISE AG (DE) 2012-05-17 US claimed
EP-2416766-A2 COMPOSITIONS COMPRISING TRANS-TERT-BUTYL CYCLOHEXANOL AS SKIN IRRITATION-REDUCING AGENT Symrise AG (DE) 2012-02-15 EP claimed
US-20100204524-A1 METHOD FOR THE PREPARATION OF CIS-4-TERT-BUTYLCYCLOHEXANOL KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2010-08-12 US claimed
EP-2173695-A1 METHOD FOR THE PREPARATION OF CIS-4-TERT-BUTYLCYCLOHEXANOL Kanata Chemical Technologies Inc. (CA) 2010-04-14 EP claimed
WO-2009087242-A2 COMPOSITIONS COMPRISING TRANS-TERT-BUTYL CYCLOHEXANOL AS SKIN IRRITATION-REDUCING AGENT SYMRISE GMBH & CO. KG (DE) 2009-07-16 WO claimed
WO-2009006734-A1 METHOD FOR THE PREPARATION OF CIS-4-TERT-BUTYLCYCLOHEXANOL KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2009-01-15 WO claimed
US-5856590-A HYDROGENATING 4-T-BUTYLCYCLOHEXANONE BY USING A SPECIFIC RUTHENIUM-PHOSPHINE COMPLEX AS A CATALYST IN THE PRESENCE OF A BASE TAKASAGO INTERNATIONAL CORPORATION (JP) 1999-01-05 US claimed
US-4343955-A CATALYTIC HYDROGENATION OF ALKYLPHENOL USING RUTHENIUM ON ALUMINA SHIN-ETSU CHEMICAL CO., LTD. (JP) 1982-08-10 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 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-12115239-B2 Cosmetic compositions, kits thereof, and methods for making and using the same CUTA, LIPC, MGLL EPHX1 2797/4885LIPA 8/4885TSHR 4421/4885
US-12144879-B2 Compositions and methods for altering the color of hair GLS, GRHPR, HCCS EPHX1 1802/4885LIPA 1391/4885TSHR 4016/4885
US-12409123-B2 Compositions and methods for altering the color of hair FPGS, CS, SQOR EPHX1 3751/4885LIPA 3039/4885TSHR 3726/4885
US-20100204524-A1 METHOD FOR THE PREPARATION OF CIS-4-TERT-BUTYLCYCLOHEXANOL TPX2, HRH2, P2RX2 EPHX1 795/4885LIPA 4707/4885TSHR 393/4885
US-20120121737-A1 COMPOSITIONS COMPRISING TRANS-TERT-BUTYL CYCLOHEXANOL AS SKIN IRRITATION-REDUCING AGENT TERT, CUTA, TRPA1 EPHX1 419/4885LIPA 212/4885TSHR 1241/4885
US-12121606-B2 Methods and compositions for improving skin CUTA, VCL, KRT18 EPHX1 2705/4885LIPA 53/4885TSHR 4566/4885
US-12109287-B2 Compositions and methods for altering the color of hair KRT18, ALDH2, FPGS EPHX1 3799/4885LIPA 1984/4885TSHR 3727/4885

“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.