SCHEMBL129151

SCHEMBL129151

CC(C)(C)c1cccc(C(C)(C)C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.56
HDAC4 P56524 1/20 0.56
HDAC2 Q92769 1/20 0.56
KIF11 P52732 3/20 0.54
ACHE P22303 4/20 0.50
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
GABRA1 P14867 1/20 0.48
GABRB2 P47870 1/20 0.48
RXRA P19793 2/20 0.47
RXRB P28702 2/20 0.47
NPC1 O15118 1/20 0.44
PLA2G1B P04054 1/20 0.44
NFKB1 P19838 1/20 0.44
CASP3 P42574 1/20 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
Water SCHEMBL29289408 0.97 HDAC8 (0.54) HDAC8HDAC4HDAC2KIF11ACHE
Methoxymethane SCHEMBL28022475 0.91 HDAC8 (0.50) HDAC8HDAC4HDAC2KIF11ACHE
Nitrogen SCHEMBL28547462 0.91 HDAC8 (0.50) HDAC8HDAC4HDAC2KIF11ACHE
SCHEMBL28328740 0.89 HDAC8 (0.54) HDAC8HDAC4HDAC2KIF11ACHE
SCHEMBL7203019 0.89 KIF11 (0.52) HDAC8HDAC4HDAC2KIF11ACHE
SCHEMBL26621934 0.89 HDAC8 (0.54) HDAC8HDAC4HDAC2KIF11ACHE
SCHEMBL9492395 0.89 HDAC8 (0.54) HDAC8HDAC4HDAC2KIF11ACHE
SCHEMBL28653353 0.89 HDAC8 (0.54) HDAC8HDAC4HDAC2KIF11ACHE
SCHEMBL29002849 0.89 HDAC8 (0.54) HDAC8HDAC4HDAC2KIF11ACHE
SCHEMBL25451230 0.87 ACHE (0.52) HDAC8HDAC4HDAC2KIF11ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122059975-A Eight-membered ring condensed boron dipyrrole compound and preparation method thereof 中国科学院宁波材料技术与工程研究所 2026-05-19 CN claimed
US-20260079169-A1 VOLATILE ORGANIC COMPOUNDS AS MARKERS FOR CELLULAR COMMUNICATION TECHNION RES & DEV FOUNDATION (IL) 2026-03-19 US claimed
EP-4696679-A1 CHIRAL PYRIDINIUM SALT CARBONYL CATALYST, AND PREPARATION METHOD THEREFOR AND USE THEREOF Shanghai Normal University (CN) 2026-02-18 EP claimed
US-20250268292-A1 PRODUCTION OF PHOSPHOLIPIDS IN MICROBES AND USES THEREOF Nourish Ingredients Pty Ltd (AU) 2025-08-28 US claimed
EP-4583720-A1 COMPOSITIONS AND METHODS FOR PRODUCING MEAT-LIKE AROMAS Nourish Ingredients Pty Ltd (AU) 2025-07-16 EP claimed
EP-4583719-A1 COMPOSITIONS AND METHODS FOR PRODUCING AROMAS Nourish Ingredients Pty Ltd (AU) 2025-07-16 EP claimed
EP-4583721-A1 COMPOSITIONS AND METHODS FOR PRODUCING MEAT-LIKE AROMAS Nourish Ingredients Pty Ltd (AU) 2025-07-16 EP claimed
EP-4583722-A1 COMPOSITIONS AND METHODS FOR PRODUCING FOOD PRODUCTS WITH MEAT-LIKE AROMAS Nourish Ingredients Pty Ltd (AU) 2025-07-16 EP claimed
CN-119936267-A Method for detecting volatile organic compounds on human body surface by combining SPME-Arrow with GC-MS/MS 公安部鉴定中心 2025-05-06 CN claimed
WO-2025002445-A1 CHIRAL PYRIDINIUM SALT CARBONYL CATALYST, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海师范大学 2025-01-02 WO claimed
EP-1910306-A1 CARBON-NITROGEN BOND FORMING PROCESS Shasun Pharma Solutions Limited (GB) 2008-04-16 EP claimed
WO-2008036932-A2 COMPOSITIONS AND METHODS COMPRISING BOSWELLIA SPECIES HERBALSCIENCE SINGAPORE PTE. LTD. (US) 2008-03-27 WO claimed
US-20070082271-A1 Non-aqueous electrolytic solution and lithium secondary battery UBE INDUSTRIES, LTD. (JP) 2007-04-12 US claimed
WO-2007017734-A1 CARBON-NITROGEN BOND FORMING PROCESS SHASUN PHARMA SOLUTIONS LIMITED (GB) 2007-02-15 WO claimed
EP-1691441-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY Ube Industries, Ltd. (JP) 2006-08-16 EP claimed
US-20060177742-A1 Nonaqueous electrolytic solution for lithium secondary battery and lithium secondary battery using the same MU IONIC SOLUTIONS CORPORATION (JP) 2006-08-10 US claimed
EP-1650826-A1 NONAQUEOUS ELECTROLYTIC SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY USING SAME Ube Industries, Ltd. (JP) 2006-04-26 EP claimed
US-6503662-B1 Tert-butylbenzene derivative prevents oxidation and decomposition of solvent at the time of charging which causes decreased battery characteristics UBE INDUSTRIES, LTD. (JP) 2003-01-07 US claimed
EP-0057882-B1 3,5-DI-TERT-BUTYLSTYRENE DERIVATIVES, PROCESSES FOR THEIR PREPARATIONS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1986-04-02 EP claimed
US-4408083-A SOLVENT EXTRACTION, THERMAL DECOMPOSITION MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1983-10-04 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-20260079169-A1 VOLATILE ORGANIC COMPOUNDS AS MARKERS FOR CELLULAR COMMUNICATION BCL2, BAX, EPCAM HDAC8 3730/4885HDAC4 2565/4885HDAC2 2912/4885

“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.