SCHEMBL4299443

SCHEMBL4299443

C=C(C)[C@H]1CCC(C)=C[C@@H]1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 10/20 0.53
CNR2 P34972 9/20 0.49
OPRM1 P35372 6/20 0.49
GPR55 Q9Y2T6 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
TRPA1 O75762 1/20 0.47
CYP1A1 P04798 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2B6 P20813 1/20 0.47
SLC6A2 P23975 1/20 0.47
CYP2C19 P33261 1/20 0.47
GPR6 P46095 1/20 0.47
SLC6A3 Q01959 1/20 0.47
NAAA Q02083 1/20 0.47
TRPM8 Q7Z2W7 1/20 0.47
TRPV1 Q8NER1 1/20 0.47
TRPV3 Q8NET8 1/20 0.47
TRPV4 Q9HBA0 1/20 0.47

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
SCHEMBL5904277 1.00 CNR1 (0.53) CNR1CNR2OPRM1GPR55MEN1
SCHEMBL25933425 1.00 CNR1 (0.53) CNR1CNR2OPRM1GPR55MEN1
SCHEMBL21759190 1.00 CNR1 (0.53) CNR1CNR2OPRM1GPR55MEN1
SCHEMBL20835188 1.00 CNR1 (0.53) CNR1CNR2OPRM1GPR55MEN1
SCHEMBL180290 1.00 CNR1 (0.53) CNR1CNR2OPRM1GPR55MEN1
SCHEMBL23847917 1.00 CNR1 (0.53) CNR1CNR2OPRM1GPR55MEN1
SCHEMBL14215885 0.90 CNR1 (0.46) CNR1CNR2OPRM1GPR55MEN1
SCHEMBL8521177 0.80 CNR1 (0.53) CNR1CNR2OPRM1GPR55MEN1
SCHEMBL31545513 0.80 CNR1 (0.53) CNR1CNR2OPRM1GPR55MEN1
SCHEMBL19852268 0.80 CNR1 (0.53) CNR1CNR2OPRM1GPR55MEN1

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
WO-2019101926-A1 MONOTERPENOID BIOSYNTHESIS THE UNIVERSITY OF MANCHESTER (GB) 2019-05-31 WO claimed
US-12129493-B2 Host cells and methods useful for producing unnatural terpenoids using a novel artificial metalloenzyme THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-10-29 US disclosed
CN-113151205-B Alcohol dehydrogenase mutant and application thereof in synthesis of cyclic terpene ketone 苏州百福安酶技术有限公司 2024-07-16 CN disclosed
US-11685724-B2 Synthetic intermediates for novel cannabinoids and cannabinoid acids and their derivatives BESSOR PHARMA, LLC (US) 2023-06-27 US disclosed
US-20210284972-A1 HOST CELLS AND METHODS USEFUL FOR PRODUCING UNNATURAL TERPENOIDS USING A NOVEL ARTIFICIAL METALLOENZYME UNITED STATES DEPARTMENT OF ENERGY 2021-09-16 US disclosed
US-20210236460-A1 Applications of Known and Novel Cannabinoids BESSOR PHARMA, LLC 2021-08-05 US disclosed
WO-2020041321-A1 PROCESS FOR THE PRODUCTION OF CANNABINOIDS BERKOWITZ BARRY A (US) 2020-02-27 WO disclosed
WO-2020041322-A1 NOVEL CANNABINOIDS AND CANNABINOID ACIDS AND THEIR DERIVATIVES BERKOWITZ BARRY A (US) 2020-02-27 WO disclosed
WO-2019101926-A1 MONOTERPENOID BIOSYNTHESIS THE UNIVERSITY OF MANCHESTER (GB) 2019-05-31 WO disclosed
EP-3134517-A1 STABILIZATION OF CYTOCHROME P450 REDUCTASE DSM IP Assets B.V. (NL) 2017-03-01 EP disclosed
WO-2015162305-A1 STABILIZATION OF CYTOCHROME P450 REDUCTASE DSM IP ASSETS B.V. (NL) 2015-10-29 WO disclosed
US-8426684-B2 Isolated menthone reductase and nucleic acid molecules encoding same WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION (US) 2013-04-23 US disclosed
CN-102413681-A Production of terpenese and terpenoids in glandular trichome-bearing plants UNIV WASHINGTON 2012-04-11 CN disclosed
US-20120052535-A1 PRODUCTION OF TERPENES AND TERPENOIDS IN GLANDULAR TRICHOME-BEARING PLANTS WASHINGTON STATE UNIVERSITY 2012-03-01 US disclosed
US-20090300801-A1 ISOLATED MENTHONE REDUCTASE AND NUCLEIC ACID MOLECULES ENCODING SAME WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-12-03 US disclosed
US-20090098626-A1 NUCLEIC ACIDS ENCODING MODIFIED CYTOCHROME P450 ENZYMES AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-04-16 US disclosed
EP-1837396-A1 Salutaridine reductase and morphine biosynthesis Institut für Pflanzenbiochemie-IPB (DE) 2007-09-26 EP disclosed
WO-2006001802-A1 ISOLATED MENTHONE REDUCTASE AND NUCLEIC ACID MOLECULES ENCODING SAME WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION (US) 2006-01-05 WO disclosed
US-6194185-B1 ISOLATED NUCLEIC ACIDS ENCODING LIMONENE-6-HYDROXYLASE AND LIMONENE-3-HYDROXYLASE; EXPRESSION VECTORS; TRANSFORMED CELLS; FOR PRODUCTION OF TRANS-CARVEOL OR ISOPIPERITENOL, INTERMEDIATES TO MONOTERPENES OF FLAVOR OR AROMA SIGNIFICANCE WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION 2001-02-27 US disclosed
US-6083731-A NUCLEIC ACID SEQUENCE CODING PLANT ENZYMATIC PROTEIN; FOR PREVENTION OF INJURY OR INFECTION WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION (US) 2000-07-04 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 (4 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-11685724-B2 Synthetic intermediates for novel cannabinoids and cannabinoid acids and their derivatives CNR2, CNR1, GPR18 CNR1 2/4885CNR2 1/4885OPRM1 58/4885
US-20210236460-A1 Applications of Known and Novel Cannabinoids CNR2, CNR1, FAAH CNR1 2/4885CNR2 1/4885OPRM1 273/4885
US-20210284972-A1 HOST CELLS AND METHODS USEFUL FOR PRODUCING UNNATURAL TERPENOIDS USING A NOVEL ARTIFICIAL METALLOENZYME CYP4F2, CYP51A1, POR CNR1 3696/4885CNR2 4301/4885OPRM1 1801/4885
US-12129493-B2 Host cells and methods useful for producing unnatural terpenoids using a novel artificial metalloenzyme CYP4F2, CYP51A1, POR CNR1 3696/4885CNR2 4301/4885OPRM1 1801/4885

“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.