SCHEMBL5863171

SCHEMBL5863171

C[N+]1(Cc2ccccc2)CCC(CCCC2CC[N+](C)(Cc3ccccc3)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACHE P22303 16/20 0.51
CHRM3 P20309 2/20 0.45
CHRM4 P08173 1/20 0.42
CHRM2 P08172 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
Water SCHEMBL5859572 0.98 ACHE (0.50) ACHECHRM3CHRM4CHRM2
SCHEMBL10265915 0.87 ACHE (0.52) ACHECHRM3CHRM4
SCHEMBL12160731 0.83 ACHE (0.48) ACHECHRM3
SCHEMBL5859581 0.79 ACHE (0.47) ACHE
SCHEMBL17069874 0.79 CHRM3 (0.45) ACHECHRM3CHRM2
SCHEMBL15610575 0.79 CHRM3 (0.47) ACHECHRM3CHRM2
SCHEMBL10256418 0.79 CHRM3 (0.50) ACHECHRM3CHRM2
SCHEMBL3681307 0.75 CHRNA7 (0.60) ACHECHRM3CHRM4CHRM2
SCHEMBL24105554 0.75 CHRNA7 (0.40) ACHECHRM3
SCHEMBL724930 0.74 CHRNB2 (0.61) CHRM3CHRM4CHRM2

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1010667-B1 Stannosilicate molecular sieves having the zeolite beta structure UOP LLC (US) 2003-10-08 EP claimed
US-10875780-B2 Synthesis of nanocrystalline beta zeolite, synthesis method and use thereof in catalytic applications UNIVERSITAT POLITECNICA DE VALENCIA (ES) 2020-12-29 US disclosed
US-20200216326-A1 Synthesis of Nanocrystalline Beta Zeolite, Synthesis Method and use Thereof in Catalytic Applications CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (CSIC) (ES) 2020-07-09 US disclosed
EP-3636595-A1 SYNTHESIS OF NANOCRYSTALLINE BETA ZEOLITE, SYNTHESIS METHOD AND USE THEREOF IN CATALYTIC APPLICATIONS Universitat Politècnica de València (ES) 2020-04-15 EP disclosed
EP-2518042-B1 PRODUCTION OF MYRTANAL FROM BETA-PINENE EPOXIDE CONSEJO SUPERIOR DE INVESTIG CIENTÍFICAS CSIC (ES) 2018-03-28 EP disclosed
US-20150353518-A1 CATALYST AND CATALYTIC PROCESS FOR THE ETHERIFICATION/REDUCTION OF FURFURYL DERIVATIVES TO TETRAHYDROFURFURYL ETHERS UNIVERSITAT POLITECNICA DE VALENCIA (ES) 2015-12-10 US disclosed
EP-2913328-A1 CATALYST AND CATALYTIC PROCESS FOR THE ETHERIFICATION/REDUCTION OF FURFURYL DERIVATIVES TO TETRAHYDROFURFURYL ETHERS Consejo Superior De Investigaciones Científicas (CSIC) (ES) 2015-09-02 EP disclosed
US-8633338-B2 Production of myrtanal from beta-pinene epoxide CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) 2014-01-21 US disclosed
US-20120330065-A1 PRODUCTION OF MYRTANAL FROM BETA-PINENE EPOXIDE CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (CSIC) (ES) 2012-12-27 US disclosed
EP-2518042-A1 PRODUCTION OF MYRTANAL FROM BETA-PINENE EPOXIDE Consejo Superior De Investigaciones Científicas (CSIC) (ES) 2012-10-31 EP disclosed
US-7087779-B2 Aldehyde conversion method using a molecular sieve and the use of the molecular sieve as a catalyst in said method CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2006-08-08 US disclosed
US-20050113604-A1 Aldehyde conversion method using a molecular sieve and the use of the molecular sieve as a catalyst in said method CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2005-05-26 US disclosed
EP-1489065-A1 ALDEHYDE CONVERSION METHOD USING A MOLECULAR SIEVE AND THE USE OF THE MOLECULAR SIEVE AS A CATALYST IN SAID METHOD CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2004-12-22 EP disclosed
WO-2003064363-A1 METHOD FOR THE PREPARATION OF AN AROMATIC ALDEHYDE RHODIA CHIMIE (FR) 2003-08-07 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 (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-20150353518-A1 CATALYST AND CATALYTIC PROCESS FOR THE ETHERIFICATION/REDUCTION OF FURFURYL DERIVATIVES TO TETRAHYDROFURFURYL ETHERS ADH1A, ADH1C, ADH5 ACHE 1803/4885CHRM3 4824/4885CHRM4 4306/4885

“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.