SCHEMBL3040178

SCHEMBL3040178

CC(C)=CCC/C(C)=C\CC/C(C)=C/COC(=O)c1ccccc1

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.75
ALDH1A1 P00352 1/20 0.58
ALOX15 P16050 1/20 0.58

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
SCHEMBL11411106 1.00 TRPV1 (0.75) TRPV1ALDH1A1ALOX15
SCHEMBL6445172 1.00 TRPV1 (0.75) TRPV1ALDH1A1ALOX15
SCHEMBL11411110 1.00 TRPV1 (0.75) TRPV1ALDH1A1ALOX15
SCHEMBL6445166 1.00 TRPV1 (0.75) TRPV1ALDH1A1ALOX15
SCHEMBL584936 0.99 TRPV1 (0.77) TRPV1ALDH1A1ALOX15
SCHEMBL584937 0.99 TRPV1 (0.77) TRPV1ALDH1A1ALOX15
SCHEMBL5312466 0.99 TRPV1 (0.77) TRPV1ALDH1A1ALOX15
SCHEMBL5605086 0.99 TRPV1 (0.77) TRPV1ALDH1A1ALOX15
SCHEMBL8625199 0.95 TRPV1 (0.72) TRPV1ALDH1A1ALOX15
SCHEMBL8625206 0.95 TRPV1 (0.72) TRPV1ALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040176311-A1 Composition and method for treating cancer MO HUANBIAO (US) 2004-09-09 US claimed
US-6699850-B2 ORAL FORMULATION OF A COMBINATION OF NITROGEN-CONTAINING BISPHOSPHONATE OR ITS SALT AND AN ISOPRENOID COMPOUND FOR INHIBITING BONE RESOPRTION IN A MAMMAL WHILE COUNTERACTING THE OCCURRENCE OF ADVERSE GASTROINTESTINAL EFFECT MERCK & CO., INC. 2004-03-02 US claimed
US-20020082244-A1 Compositions and methods for inhibiting bone resorption MERCK & CO., INC. 2002-06-27 US claimed
WO-1999067809-A9 COMPOSITIONS AND METHODS FOR INHIBITING BONE RESORPTION MERCK & CO INC (US) 2001-03-22 WO claimed
EP-1061907-A1 MONOTERPENOID DERIVATIVES FOR TREATMENT OF CANCER WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2000-12-27 EP claimed
WO-1999045912-A1 MONOTERPENOID DERIVATIVES FOR TREATMENT OF CANCER WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1999-09-16 WO claimed
US-4214909-A SESQUITERPENE ALCOHOLS AND CARBOXYLIC ACID ESTERS THEREOF KURARAY CO., LTD. (JP) 1980-07-29 US claimed
CN-108250055-B Preparation method of pyruvylgeranyl pyrophosphate intermediate 重庆医药工业研究院有限责任公司 2022-08-05 CN disclosed
US-9199900-B2 Method for converting farnesol to nerolidol in the presence of alpha-bisabolol SYMRISE AG (DE) 2015-12-01 US disclosed
US-20130289317-A1 Method for Converting Farnesol to Nerolidol in the Presence of Alpha-Bisabolol SYMRISE AG (DE) 2013-10-31 US disclosed
US-20100222606-A1 METHOD FOR PRODUCING BISABOLOL WHICH IS FARNESOL FREE OR IS LOW IN FARNESOL BASF SE (DE) 2010-09-02 US disclosed
US-7074825-B2 Composition and method for treating cancer MO HUANBIAO 2006-07-11 US disclosed
US-6911318-B2 Bacterial transglycosylases: assays for monitoring the activity using Lipid II substrate analogs and methods for discovering new antibiotics THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2005-06-28 US disclosed
WO-1999067809-A9 COMPOSITIONS AND METHODS FOR INHIBITING BONE RESORPTION MERCK & CO INC (US) 2001-03-22 WO disclosed
EP-1061907-A1 MONOTERPENOID DERIVATIVES FOR TREATMENT OF CANCER WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2000-12-27 EP disclosed
EP-1061907-A1 MONOTERPENOID DERIVATIVES FOR TREATMENT OF CANCER WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2000-12-27 EP disclosed
WO-2000052035-A1 BACTERIAL TRANSGLYCOSYLASES: ASSAYS FOR MONITORING THE ACTIVITY USING LIPID II SUBSTRATE ANALOGS AND METHODS FOR DISCOVERING NEW ANTIBIOTICS PRINCETON UNIVERSITY (US) 2000-09-08 WO disclosed
WO-1999045912-A1 MONOTERPENOID DERIVATIVES FOR TREATMENT OF CANCER WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1999-09-16 WO disclosed
WO-1999045912-A1 MONOTERPENOID DERIVATIVES FOR TREATMENT OF CANCER WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1999-09-16 WO disclosed
US-5466718-A Inhibiting melanin formation TAKASAGO INSTITUTE FOR INTERDISCIPLINARY (US) 1995-11-14 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 (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-20130289317-A1 Method for Converting Farnesol to Nerolidol in the Presence of Alpha-Bisabolol FNTB, FNTA, FHIT TRPV1 2002/4885ALDH1A1 938/4885ALOX15 2071/4885
US-20020082244-A1 Compositions and methods for inhibiting bone resorption SOST, PTEN, ALPI TRPV1 1672/4885ALDH1A1 4552/4885ALOX15 441/4885
US-20100222606-A1 METHOD FOR PRODUCING BISABOLOL WHICH IS FARNESOL FREE OR IS LOW IN FARNESOL FHIT, FDPS, FNTA TRPV1 592/4885ALDH1A1 856/4885ALOX15 292/4885

“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.