SCHEMBL2004079

SCHEMBL2004079

C=CC(C)(CC/C=C(\C)CCC=C(C)C)OC(C)=O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.59
ALDH1A1 P00352 2/20 0.47
KMT2A Q03164 2/20 0.46
FNTA P49354 4/20 0.43
FNTB P49356 4/20 0.43
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
CYP3A4 P08684 1/20 0.42
UGT1A1 P22309 1/20 0.42
SQLE Q14534 2/20 0.41
GGPS1 O95749 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL22372389 1.00 ALOX15 (0.59) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL22372388 1.00 ALOX15 (0.59) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL15914304 1.00 ALOX15 (0.59) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL9017126 1.00 ALOX15 (0.59) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL2004080 1.00 ALOX15 (0.59) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL9017160 1.00 ALOX15 (0.59) ALOX15ALDH1A1KMT2AFNTAFNTB
SCHEMBL3506100 1.00 ALOX15 (0.59) ALOX15ALDH1A1KMT2AFNTAFNTB
Linalyl Acetate SCHEMBL11793344 0.93 ALOX15 (0.51) ALOX15ALDH1A1KMT2AFNTAFNTB
Linalyl Acetate SCHEMBL11793327 0.93 ALOX15 (0.51) ALOX15ALDH1A1KMT2AFNTAFNTB
Linalyl Acetate SCHEMBL15745425 0.91 ALOX15 (0.52) ALOX15ALDH1A1CYP3A4KDM4EATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107815344-B Environment-friendly semisynthetic cutting fluid and preparation method thereof 广州市联诺化工科技有限公司 2020-08-25 CN claimed
US-20250261684-A1 SMOKELESS TOBACCO PRODUCT FOR ORAL USE AND SOFT CAPSULE USED THEREIN SUNSHO PHARMACEUTICAL CO., LTD. (JP) 2025-08-21 US disclosed
US-12344569-B2 Process for making a conjugated diene from an allyl alcohol GIVAUDAN SA (CH) 2025-07-01 US disclosed
WO-2025070466-A1 SEAMLESS CAPSULE FOR ORAL CAVITY 森下仁丹株式会社 2025-04-03 WO disclosed
EP-4420534-A1 SMOKELESS TOBACCO PRODUCT FOR ORAL USE AND SOFT CAPSULE USED THEREIN Sunsho Pharmaceutical Co., Ltd. (JP) 2024-08-28 EP disclosed
EP-4168383-B1 PROCESS FOR MAKING A CONJUGATED DIENE FROM AN ALLYL ALCOHOL GIVAUDAN SA (CH) 2024-07-31 EP disclosed
US-20240192184-A1 DETECTION OF FLAVOUR LOSS GIVAUDAN SA (CH) 2024-06-13 US disclosed
CN-113316398-B Seamless capsule, filter and smoking article comprising same 三生医药株式会社 2024-06-11 CN disclosed
CN-118159258-A Composition containing caryophyllene 三生医药株式会社 2024-06-07 CN disclosed
US-20240180219-A1 SEAMLESS CAPSULE STABLY DISINTEGRABLE EVEN IN HIGH-TEMPERATURE AND HIGH-HUMIDITY ENVIRONMENT, AND METHOD FOR PRODUCING THE SAME MORISHITA JINTAN CO., LTD. (JP) 2024-06-06 US disclosed
WO-2013002421-A1 ANTIMICROBIAL COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-01-03 WO disclosed
US-7964637-B2 Process for producing optically active theaspirane TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-06-21 US disclosed
US-20090270516-A1 Process for Producing Optically Active Theaspirane TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-29 US disclosed
EP-2020225-A2 Fragrance composition Kao Corporation (JP) 2009-02-04 EP disclosed
US-20050245407-A1 Fragrance composition KAO CORPORATION (JP) 2005-11-03 US disclosed
EP-1552814-A1 FRAGRANCE COMPOSITION Kao Corporation (JP) 2005-07-13 EP disclosed
US-4446125-A Use of isomeric farnesene product-by-process for augmenting or enhancing the aroma or taste of foodstuffs, chewing gums, medicinal products and toothpastes INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1984-05-01 US disclosed
US-4391717-A Use of isomeric farnesene product-by-process for augmenting or enhancing the aroma of perfume compositions, colognes and perfumed articles INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-07-05 US disclosed
US-4390444-A PREPARED BY DEHYDRATING NEROLIDOL INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-06-28 US disclosed
US-4376068-A Use of isomeric farnesene product-by-process for augmenting or enhancing the aroma of perfume compositions, colognes and perfumed articles INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1983-03-08 US 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-12344569-B2 Process for making a conjugated diene from an allyl alcohol ADH1C, ADH1A, ADH5 ALOX15 147/4885ALDH1A1 17/4885KMT2A 1850/4885
US-20090270516-A1 Process for Producing Optically Active Theaspirane DHPS, ALDH7A1, FASN ALOX15 389/4885ALDH1A1 38/4885KMT2A 1705/4885

“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.