SCHEMBL579240

SCHEMBL579240

CC(CCOC(=O)CC(C)CC(C)(C)C)CC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.38
ALOX15 P16050 1/20 0.35
CYP19A1 P11511 1/20 0.32

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
SCHEMBL23002629 0.92 EGFR (0.34) EGFRALOX15
SCHEMBL28647748 0.91 CYP19A1 (0.41) EGFRCYP19A1
SCHEMBL15518346 0.87 ADRA2A (0.41) EGFRALOX15CYP19A1
SCHEMBL4408719 0.85 NAAA (0.41)
SCHEMBL3068386 0.85 ALDH1A1 (0.32)
SCHEMBL4412782 0.85 NAAA (0.41)
SCHEMBL8041406 0.85 NAAA (0.33)
SCHEMBL4407978 0.85 NAAA (0.41)
SCHEMBL16269275 0.85 NAAA (0.41) EGFRALOX15CYP19A1
SCHEMBL22754179 0.84 EGFR (0.31) EGFRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2887929-A2 COMPOUNDS FOR PREVENTING, REDUCING AND/OR ALLEVIATING ITCHY SKIN CONDITION(S) Symrise AG (DE) 2015-07-01 EP claimed
US-9060943-B2 Compositions comprising trans-tert-butyl cyclohexanol as skin irritation-reducing agent SYMRISE AG (DE) 2015-06-23 US claimed
WO-2012143576-A2 COMPOUNDS FOR PREVENTING, REDUCING AND/OR ALLEVIATING ITCHY SKIN CONDITION(S) SYMRISE AG (DE) 2012-10-26 WO 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
WO-2009087242-A2 COMPOSITIONS COMPRISING TRANS-TERT-BUTYL CYCLOHEXANOL AS SKIN IRRITATION-REDUCING AGENT SYMRISE GMBH & CO. KG (DE) 2009-07-16 WO claimed
EP-3829301-B1 COMBINATIONS CONTAINING PVA AND CERTAIN HERBICIDES WITH IMPROVED PROPERTIES BAYER AG (DE) 2025-08-06 EP disclosed
EP-3829302-B1 HERBICIDE COMPOSITIONS WITH IMPROVED PROPERTIES BAYER AG (DE) 2025-08-06 EP disclosed
US-12342814-B2 Herbicide compositions with improved properties BAYER AKTIENGESELLSCHAFT (DE) 2025-07-01 US disclosed
US-12342815-B2 Combinations containing PVA and certain herbicides with improved properties BAYER AKTIENGESELLSCHAFT (DE) 2025-07-01 US disclosed
CN-119564543-A Elastic pearlescent eye shadow paint and preparation method thereof 上海臻臣化妆品有限公司 2025-03-07 CN disclosed
US-20240335364-A1 COMPOSITIONS OF DICAFFEOYLQUINIC ACIDS WITH TOCOPHEROL SYMRISE AG (DE) 2024-10-10 US disclosed
EP-4442241-A2 RETINOL REPLACEMENT IN SKIN TREATMENT Symrise AG (DE) 2024-10-09 EP disclosed
US-6193986-B1 STORABILITY, WATER IN OIL EMULSION USABLE IN FOODS, FEEDS, COSMETICS, MEDICINES, AGRICULTURAL CHEMICALS, MACHINES AND VARIOUS INDUSTRIAL FIELDS THE NISSHIN OIL MILLS, LTD. (JP) 2001-02-27 US disclosed
US-6190680-B1 STORAGE STABILITY; CAN BE USED IN FOOD, FEEDS, MEDICINE, AGRICULTURAL CHEMICALS, COSMETICS THE NISSHIN OIL MILLS, LTD. (JP) 2001-02-20 US disclosed
US-6117434-A POLYHYDRIC ALCOHOL, LECITHIN, AND 3-METHYL-1,3-BUTANEDIOL; STABILITY; MOISTURIZERS THE NISSHIN OIL MILLS LTD. (JP) 2000-09-12 US disclosed
EP-0863192-A1 HUMECTANT COMPOSITION, BASE CONTAINING THE SAME, AND COSMETIC MATERIAL OR EXTERNAL PREPARATION CONTAINING SAID HUMECTANT COMPOSITION THE NISSHIN OIL MILLS, LTD. (JP) 1998-09-09 EP disclosed
US-5711939-A IMPROVED SPREADABILITY, WATER VAPOR PERMEABILITY, ETHYLHEXYL ESTER OF ETHYLHEXANOIC ACID DRAGOCO GERBERDING & CO., GMBH (DE) 1998-01-27 US disclosed
EP-0116621-A1 UTILISATION OF BRANCHED CHAIN CARBONIC ACID ESTERS WITH BRANCHED CHAIN ALCOHOLS AS COMPONENTS OF COSMETIC PRODUCTS. DRAGOCO GERBERDING CO GMBH (DE) 1984-08-29 EP disclosed
WO-1984000884-A1 UTILISATION OF BRANCHED CHAIN CARBONIC ACID ESTERS WITH BRANCHED CHAIN ALCOHOLS AS COMPONENTS OF COSMETIC PRODUCTS DRAGOCO GERBERDING CO GMBH (DE) 1984-03-15 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 (3 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-12342814-B2 Herbicide compositions with improved properties DDT, HDHD5, GMDS EGFR 2784/4885ALOX15 3591/4885CYP19A1 615/4885
US-12342815-B2 Combinations containing PVA and certain herbicides with improved properties DDT, PFAS, ADH1C EGFR 3831/4885ALOX15 4579/4885CYP19A1 1878/4885
US-20120121737-A1 COMPOSITIONS COMPRISING TRANS-TERT-BUTYL CYCLOHEXANOL AS SKIN IRRITATION-REDUCING AGENT TERT, CUTA, TRPA1 EGFR 544/4885ALOX15 336/4885CYP19A1 180/4885

“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.