SCHEMBL8731628

SCHEMBL8731628

C=C/C(C)=C/C[C@@H]1[C@@]2(C)CCCC(C)(C)[C@@H]2CC[C@@]1(C)O

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.57
MAPT P10636 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2C9 P11712 2/20 0.57
TSHR P16473 2/20 0.57
CYP2C19 P33261 2/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
TRPV1 Q8NER1 1/20 0.48
POLB P06746 1/20 0.44
TRPA1 O75762 2/20 0.41
PNLIP P16233 2/20 0.37
PTPN1 P18031 3/20 0.36
PTPN2 P17706 2/20 0.36
CYP19A1 P11511 1/20 0.34
IDO1 P14902 1/20 0.33
UGT2B7 P16662 4/20 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
SCHEMBL15220009 1.00 ALDH1A1 (0.57) ALDH1A1MAPTCYP3A4CYP2C9TSHR
SCHEMBL9549996 1.00 ALDH1A1 (0.57) ALDH1A1MAPTCYP3A4CYP2C9TSHR
SCHEMBL541382 1.00 ALDH1A1 (0.57) ALDH1A1MAPTCYP3A4CYP2C9TSHR
SCHEMBL9550004 1.00 ALDH1A1 (0.57) ALDH1A1MAPTCYP3A4CYP2C9TSHR
SCHEMBL25669585 1.00 ALDH1A1 (0.57) ALDH1A1MAPTCYP3A4CYP2C9TSHR
SCHEMBL18089046 1.00 ALDH1A1 (0.57) ALDH1A1MAPTCYP3A4CYP2C9TSHR
SCHEMBL18949253 0.87 ALDH1A1 (0.46) ALDH1A1MAPTCYP3A4CYP2C9TSHR
SCHEMBL9623433 0.86 ALDH1A1 (0.62) ALDH1A1MAPTCYP3A4CYP2C9TSHR
SCHEMBL9623437 0.86 ALDH1A1 (0.62) ALDH1A1MAPTCYP3A4CYP2C9TSHR
SCHEMBL8733677 0.86 MAPT (0.44) ALDH1A1MAPTCYP3A4CYP2C9TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5773005-A ENZYME INHIBITORS, ANTISECRETORY AGENTS AND ANTIANDROGENS KABUSHIKI KAISHA YAKURIGAKU CHUO KENKYUSHO (JP) 1998-06-30 US claimed
US-20250333756-A1 ENGINEERING TOMATO FRUITS AS A PRODUCTION PLATFORM FOR TERPENOID PRODUCTS UNIV MICHIGAN STATE (US) 2025-10-30 US disclosed
US-20250002947-A1 RECOMBINANT MANUFACTURE OF C-20 TERPENOID ALCOHOLS ISOBIONICS B.V. (NL) 2025-01-02 US disclosed
EP-4367255-A1 RECOMBINANT MANUFACTURE OF C-20 TERPENOID ALCOHOLS Isobionics B.V. (NL) 2024-05-15 EP disclosed
US-20240124899-A1 METHODS FOR PRODUCTION OF NOVEL DITERPENE SCAFFOLDS UNIV MICHIGAN STATE (US) 2024-04-18 US disclosed
CN-117616128-A Recombinant production of C-20 terpene alcohols 艾瑟拜奥尼克斯公司 2024-02-27 CN disclosed
CN-111132544-B Hybrid tobacco plants from crosses between cured and air-cured tobacco types 英美烟草(投资)有限公司 2024-02-06 CN disclosed
US-11827915-B2 Method for production of novel diterpene scaffolds BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2023-11-28 US disclosed
CN-116656852-A CAPS (CAPS tag) for detecting Abi (Abi) of tobacco cis-abietyl gene and application thereof 云南省烟草农业科学研究院 2023-08-29 CN disclosed
CN-113957169-B Codominant SSR molecular marker closely linked with cis-cold shirt gene qAbl and application thereof 云南省烟草农业科学研究院 2023-08-08 CN disclosed
US-20230159961-A1 BIOSYNTHESIS OF CHEMICALLY DIVERSIFIED NON-NATURAL TERPENE PRODUCTS BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2023-05-25 US disclosed
WO-2023280677-A1 RECOMBINANT MANUFACTURE OF C-20 TERPENOID ALCOHOLS ISOBIONICS B.V. (NL) 2023-01-12 WO disclosed
US-20220372526-A1 METHOD FOR PRODUCTION OF NOVEL DITERPENE SCAFFOLDS UNITED STATES DEPARTMENT OF ENERGY 2022-11-24 US disclosed
EP-4054542-A1 BIOSYNTHESIS OF CHEMICALLY DIVERSIFIED NON-NATURAL TERPENE PRODUCTS Board Of Trustees Of Michigan State University (US) 2022-09-14 EP disclosed
US-11439115-B2 Hybrid tobacco plants from crosses between flue-cured and air-cured tobacco types BRITISH AMERICAN TOBACCO (INVESTMENTS) LIMITED (GB) 2022-09-13 US disclosed
US-20220256794-A1 TERPENE SYNTHASES AND TRANSPORTERS THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (IL) 2022-08-18 US disclosed
EP-3966340-A1 TERPENE SYNTHASES AND TRANSPORTERS The State of Israel, Ministry of Agriculture & Rural Development, Agricultural Research Organization (ARO) (Volcani Institute) (IL) 2022-03-16 EP disclosed
CN-113957169-A Codominant SSR molecular marker closely linked with cis-cold chain alcohol-based gene qAbl and application thereof 云南省烟草农业科学研究院 2022-01-21 CN disclosed
US-5773005-A ENZYME INHIBITORS, ANTISECRETORY AGENTS AND ANTIANDROGENS KABUSHIKI KAISHA YAKURIGAKU CHUO KENKYUSHO (JP) 1998-06-30 US disclosed
EP-0747048-A2 Diterpenes and flavonoids as 5-alpha-reductase inhibitors Kabushiki Kaisha Yakurigaku Chuo Kenkyusho (JP) 1996-12-11 EP 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 (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-20230159961-A1 BIOSYNTHESIS OF CHEMICALLY DIVERSIFIED NON-NATURAL TERPENE PRODUCTS GGPS1, DHPS, FDPS ALDH1A1 941/4885MAPT 4373/4885CYP3A4 19/4885

“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.