SCHEMBL94533

SCHEMBL94533

CC(C)c1cc(C(C)C)c(O)c(C(C)C)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 6/20 0.77
GABRB2 P47870 3/20 0.77
CA1 P00915 2/20 0.67
CA2 P00918 2/20 0.67
GABRB1 P18505 5/20 0.61
FABP3 P05413 2/20 0.54
FABP4 P15090 2/20 0.54
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 2/20 0.52
FAAH O00519 1/20 0.52
LMNA P02545 1/20 0.52
HPGD P15428 1/20 0.52
TSHR P16473 1/20 0.52
GABRG2 P18507 1/20 0.52
PTGS1 P23219 1/20 0.52
SLC6A2 P23975 1/20 0.52
HTR2C P28335 1/20 0.52
GABRB3 P28472 1/20 0.52
GABRA5 P31644 1/20 0.52
GABRA3 P34903 1/20 0.52

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
Ammonia Solution, Strong SCHEMBL28098766 0.97 GABRA1 (0.74) GABRA1GABRB2CA1CA2GABRB1
SCHEMBL15064751 0.87 GABRA1 (0.68) GABRA1GABRB2CA1CA2GABRB1
SCHEMBL1617739 0.87 GABRA1 (1.00) GABRA1GABRB2CA1CA2GABRB1
SCHEMBL9229754 0.87 CA1 (0.64) GABRA1GABRB2CA1CA2GABRB1
SCHEMBL10966386 0.86 CA1 (0.64) GABRA1GABRB2CA1CA2GABRB1
SCHEMBL30467045 0.85 GABRA1 (0.65) GABRA1GABRB2CA1CA2GABRB1
SCHEMBL19621818 0.85 CA1 (0.77) GABRA1GABRB2CA1CA2GABRB1
SCHEMBL6943696 0.85 GABRA1 (0.65) GABRA1GABRB2CA1CA2GABRB1
SCHEMBL26521897 0.84 GABRA1 (0.63) GABRA1GABRB2CA1CA2GABRB1
SCHEMBL4862739 0.84 GABRA1 (0.63) GABRA1GABRB2CA1CA2GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12618179-B2 Dedust compositions for treatment of mineral fibers CARGILL, INCORPORATED (US) 2026-05-05 US claimed
US-20220298688-A1 DEDUST COMPOSITIONS FOR TREATMENT OF MINERAL FIBERS CARGILL, INCORPORATED (US) 2022-09-22 US claimed
EP-3927775-A1 DEDUST COMPOSITIONS FOR TREATMENT OF MINERAL FIBERS Cargill, Incorporated (US) 2021-12-29 EP claimed
CN-108250341-B Catalyst system containing metallocene compound and method for catalyzing olefin polymerization by using catalyst system 北京引发科技有限公司 2020-12-11 CN claimed
CN-109400448-A A method of producing the aromachemicals based on alkyl phenol by enzymolysis xylogen 定州市荣鼎水环境生化技术有限公司 2019-03-01 CN claimed
CN-108250341-A The method of catalyst system and its catalysis in olefine polymerization containing metallocene compound 北京引发科技有限公司 2018-07-06 CN claimed
CN-107793510-A Non-metallocene compound and ethylene styrene copolymer and preparation method and catalyst for olefines polymerizing composition and its application 中国石油化工股份有限公司 2018-03-13 CN claimed
US-9551712-B2 Volatile organic compounds as diagnostic markers for various types of cancer TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2017-01-24 US claimed
CN-101180353-B Stabilizer blends for improved chlorine resistance CHEMTURA CORP 2013-09-11 CN claimed
US-20120326092-A1 VOLATILE ORGANIC COMPOUNDS AS DIAGNOSTIC MARKERS FOR VARIOUS TYPES OF CANCER TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2012-12-27 US claimed
EP-0274200-B1 Polyolefins stabilized against oxidative degradation with mixtures of aralkyl-substituted diarylamines and sterically hindered phosphites UNIROYAL CHEM CO INC (US) 1994-02-02 EP claimed
EP-0309285-A2 Polypropylene stabilized against oxidative degradation with mixtures of diarylamine derivatives and sterically hindered phenols UNIROYAL CHEMICAL COMPANY, Inc. (US) 1989-03-29 EP claimed
EP-0274200-A2 Polyolefins stabilized against oxidative degradation with mixtures of aralkyl-substituted diarylamines and sterically hindered phosphites UNIROYAL CHEMICAL COMPANY, Inc. (US) 1988-07-13 EP claimed
EP-0271235-A2 Polypropylene stabilized against oxidative degradation with mixtures of aralkyl-substituted diarylamines and sterically hindered phenols UNIROYAL CHEMICAL COMPANY, Inc. (US) 1988-06-15 EP claimed
EP-0135607-A1 Preparation of 2,4,6-trialkylphenols UOP INC. (US) 1985-04-03 EP claimed
US-4440696-A FROM A PHENOL AND PHOSPHORUS TRIHALIDE, AMINE OR AMIDE CATALYST CIBA-GEIGY CORPORATION (US) 1984-04-03 US claimed
US-4418223-A ALKYLATION, ALUMINA-SILICA CATALYST UOP INC. (US) 1983-11-29 US claimed
US-4398048-A CATALYTIC ALKYLATION WITH OLEFIN UOP INC. (US) 1983-08-09 US claimed
US-4275248-A CATALYTIC ALKYLATION OF PHENOL WITH PROPYLENE USING FLUORIDED ALUMINA AS CATALYST UOP INC. (US) 1981-06-23 US claimed
US-3981813-A HYDROCARBON OILS STANDARD OIL COMPANY (INDIANA) (US) 1976-09-21 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 (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-12618179-B2 Dedust compositions for treatment of mineral fibers FABP4, DGAT2, DGAT1 GABRA1 4301/4885GABRB2 4173/4885CA1 2785/4885

“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.