Butylated Hydroxytoluene

Butylated Hydroxytoluene

SCHEMBL20982068

CCOCC.Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.72
▸ CA2 P00918 3/20 0.72
▸ SMN1; SMN2 Q16637 3/20 0.72
▸ POLB P06746 1/20 0.72
▸ TYR P14679 1/20 0.72
▸ HSPA5 P11021 2/20 0.58
▸ CYP2C9 P11712 5/20 0.56
▸ CYP2C19 P33261 5/20 0.56
▸ HIF1A Q16665 5/20 0.56
▸ CA1 P00915 2/20 0.50
▸ CYP2D6 P10635 2/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ PTGS1 P23219 2/20 0.44
▸ PTGS2 P35354 2/20 0.44
▸ LMNA P02545 3/20 0.44
▸ TSHR P16473 3/20 0.44
▸ GAA P10253 2/20 0.44
▸ HMGCR P04035 2/20 0.44
▸ NR1I2 O75469 1/20 0.44
▸ CYP1A2 P05177 3/20 0.44

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
Butylated Hydroxytoluene SCHEMBL11647738 1.00 ALDH1A1 (0.72) ALDH1A1CA2SMN1; SMN2POLBTYR
Butylated Hydroxytoluene SCHEMBL994118 0.85 ALDH1A1 (0.82) ALDH1A1CA2SMN1; SMN2POLBTYR
Butylated Hydroxytoluene SCHEMBL453824 0.85 SMN1; SMN2 (1.00) ALDH1A1CA2SMN1; SMN2POLBTYR
Butylated Hydroxytoluene SCHEMBL3950 0.85 SMN1; SMN2 (1.00) ALDH1A1CA2SMN1; SMN2POLBTYR
Butylated Hydroxytoluene SCHEMBL125095 0.83 SMN1; SMN2 (0.78) ALDH1A1CA2SMN1; SMN2POLBTYR
Butylated Hydroxytoluene SCHEMBL4170581 0.83 SMN1; SMN2 (0.95) ALDH1A1CA2SMN1; SMN2POLBTYR
Butylated Hydroxytoluene SCHEMBL9343307 0.83 SMN1; SMN2 (0.95) ALDH1A1CA2SMN1; SMN2POLBTYR
Butylated Hydroxytoluene SCHEMBL20660368 0.83 SMN1; SMN2 (0.95) ALDH1A1CA2SMN1; SMN2POLBTYR
Butylated Hydroxytoluene SCHEMBL9343306 0.83 SMN1; SMN2 (0.95) ALDH1A1CA2SMN1; SMN2POLBTYR
Butylated Hydroxytoluene SCHEMBL11859223 0.83 SMN1; SMN2 (0.95) ALDH1A1CA2SMN1; SMN2POLBTYR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11084790-B2 Insoluble complex or solvate thereof, pharmaceutical composition and use thereof Fruithy Holdings Limited (CN) 2021-08-10 — — US claimed
CN-109996787-A Slightly solubility compound or its solvate, pharmaceutical composition and its application 合肥合源药业有限公司 2019-07-09 — — CN claimed
EP-3486233-A1 POORLY SOLUBLE COMPLEX OR SOLVATE THEREOF, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF FRUITHY HOLDINGS LIMITED (CN) 2019-05-22 — — EP claimed
CN-107848973-A The dimethylaniline formyl piperidine crystal of 1 propyl group of S () 2 ', 6 ' and its sustained release preparation 四川海思科制药有限公司 2018-03-27 — — CN claimed
US-11084790-B2 Insoluble complex or solvate thereof, pharmaceutical composition and use thereof Fruithy Holdings Limited (CN) 2021-08-10 — — US disclosed
US-20210087144-A1 INSOLUBLE COMPLEX OR SOLVATE THEREOF, PHARMACEUTICAL COMPOSTION AND USE THEREOF Fruithy Holdings Limited (CN) 2021-03-25 — — US disclosed
EP-3486233-B1 POORLY SOLUBLE COMPLEX OR SOLVATE THEREOF, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF FRUITHY HOLDINGS LTD (CN) 2021-01-27 — — EP disclosed
CN-110812365-A Composition, preparation method and preparation thereof 明特奇点医疗科技(北京)有限公司 2020-02-21 — — CN disclosed
CN-110139862-A It can be used as the bicyclic heterocycles derivative of ROMK channel inhibitor being substituted 百时美施贵宝公司 2019-08-16 — — CN disclosed
CN-109996787-A Slightly solubility compound or its solvate, pharmaceutical composition and its application 合肥合源药业有限公司 2019-07-09 — — CN disclosed
EP-3486233-A1 POORLY SOLUBLE COMPLEX OR SOLVATE THEREOF, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF FRUITHY HOLDINGS LIMITED (CN) 2019-05-22 — — EP disclosed
CN-106061967-B The nicotinamide compounds replaced through heteroaryl 百时美施贵宝公司 2019-04-19 — — CN disclosed
CN-103860476-B lutein water-soluble powder and preparation method thereof 广州新济药业科技有限公司 2017-06-23 — — CN disclosed
CN-101772302-B Boron-containing small molecules ANACOR PHARMACEUTICALS INC 2014-05-07 — — CN disclosed
CN-1809340-B Pharmaceutical products EURO CELTIQUE SA 2013-07-10 — — CN disclosed
CN-101835377-A Pyrazole compounds for controlling invertebrate pests BASF SE 2010-09-15 — — CN disclosed
CN-101772302-A Boron-containing small molecules ANACOR PHARMACEUTICALS INC 2010-07-07 — — CN disclosed
CN-1809340-A Pharmaceutical products EURO CELTIQUE SA (LU) 2006-07-26 — — CN disclosed
CN-1232593-C Coating composition for modifying hard surfaces PROCTER & GAMBLE (US) 2005-12-21 — — CN disclosed
CN-1439041-A Coating composition for modifying hard surfaces PROCTER & GAMBLE (US) 2003-08-27 — — CN 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-11084790-B2 Insoluble complex or solvate thereof, pharmaceutical composition and use thereof SYMPK, GUCY1A1, CYP3A5 ALDH1A1 1077/4885CA2 971/4885SMN1; SMN2 435/4885
US-20210087144-A1 INSOLUBLE COMPLEX OR SOLVATE THEREOF, PHARMACEUTICAL COMPOSTION AND USE THEREOF TTR, CUL5, CUL3 ALDH1A1 1869/4885CA2 949/4885SMN1; SMN2 838/4885

“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.

Send feedback