SCHEMBL1796201

SCHEMBL1796201

CC(=O)OC(C)O[CH]OC(C)OC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
TBXA2R P21731 1/20 0.38
GALR3 O60755 1/20 0.37
MAPT P10636 1/20 0.37
BLM P54132 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 2/20 0.32
TRPV1 Q8NER1 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ALOX15 P16050 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30

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
SCHEMBL248623 0.82
SCHEMBL838190 0.82
SCHEMBL6806645 0.80
SCHEMBL987906 0.80 TSHR (0.65) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL15077030 0.78
SCHEMBL8775768 0.77 TSHR (0.42) TSHRCHRM2CHRM4CHRM1TBXA2R
Acetic Acid SCHEMBL11076307 0.75 TSHR (0.58) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL16198017 0.75 TSHR (0.58) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL1460735 0.75 TSHR (0.58) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL3392585 0.74 TSHR (0.50) TSHRCHRM2CHRM4CHRM1TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4008722-A1 NOVEL RIG-I LIGANDS Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2022-06-08 EP disclosed
EP-3398956-B1 NOVEL RIG-I LIGANDS AND METHODS FOR PRODUCING THEM UNIV BONN RHEINISCHE FRIEDRICH WILHELMS (DE) 2021-11-03 EP disclosed
US-11142763-B2 RIG-I ligands and methods for producing them Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2021-10-12 US disclosed
US-11136578-B2 In vivo gene silencing by chemically modified and stable siRNA UNIVERSITY OF MASSACHUSETTS (US) 2021-10-05 US disclosed
EP-3199538-B1 PURIFICATION OF TRIPHOSPHORYLATED OLIGONUCLEOTIDES USING CAPTURE TAGS AND MODIFIED TRIPHOSPHORYLATED OLIGONUCLEOTIDES AS ACTIVATORS OF RIG-1 HELICASE UNIV BONN RHEINISCHE FRIEDRICH WILHELMS (DE) 2020-05-27 EP disclosed
US-20190085328-A1 IN VIVO SILENCING BY CHEMICALLY MODIFIED AND STABLE siRNA UNIVERSITY OF MASSACHUSETTS 2019-03-21 US disclosed
EP-3398956-A1 NOVEL RIG-I LIGANDS AND METHODS FOR PRODUCING THEM Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2018-11-07 EP disclosed
US-20180312841-A1 NOVEL RIG-I LIGANDS AND METHODS FOR PRODUCING THEM Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2018-11-01 US disclosed
US-10087441-B2 In vivo gene silencing by chemically modified and stable siRNA UNIVERSITY OF MASSACHUSETTS (US) 2018-10-02 US disclosed
US-10072262-B2 RIG-I ligands and methods for producing them Rheinische Friedrich-Wilhelms-Universität Bonn (DE) 2018-09-11 US disclosed
WO-2007092182-A2 RNA INTERFERENCE AGENTS FOR THERAPEUTIC USE UNIVERSITY OF MASSACHUSETTS (US) 2007-08-16 WO disclosed
US-20060069050-A1 Methods and compositions for mediating gene silencing UNIVERSITY OF MASSACHUSETTS (US) 2006-03-30 US disclosed
US-20050273868-A1 Methods and compositions for enhancing RISC activity in vitro and in vivo UNIVERSITY OF MASSACHUSETTS (US) 2005-12-08 US disclosed
WO-2005079532-A2 METHODS AND COMPOSITIONS FOR ENHANCING RISC ACTIVITY IN VITRO AND IN VIVO UNIVERSITY OF MASSACHUSETTS (US) 2005-09-01 WO disclosed
WO-2005079533-A2 METHODS AND COMPOSITIONS FOR MEDIATING GENE SILENCING UNIVERSITY OF MASSACHUSETTS (US) 2005-09-01 WO disclosed
EP-1556402-A2 IN VIVO GENE SILENCING BY CHEMICALLY MODIFIED AND STABLE SIRNA University of Massachusetts (US) 2005-07-27 EP disclosed
US-20050020521-A1 Rna interference strands and antibody strands UNIVERSITY OF MASSACHUSETTS (US) 2005-01-27 US disclosed
US-20040152651-A1 Regulation of transcription elongation factors NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-08-05 US disclosed
WO-2004041838-A1 REGULATION OF TRANSCRIPTION ELONGATION FACTORS UNIVERSITY OF MASSACHUSETTS (US) 2004-05-21 WO disclosed
WO-2004029212-A2 IN VIVO GENE SILENCING BY CHEMICALLY MODIFIED AND STABLE SIRNA UNIVERSITY OF MASSACHUSETTS (US) 2004-04-08 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 (7 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-20190085328-A1 IN VIVO SILENCING BY CHEMICALLY MODIFIED AND STABLE siRNA AGO2, SNRPE, NSUN2 TSHR 3904/4885CHRM2 4685/4885CHRM4 4730/4885
US-11142763-B2 RIG-I ligands and methods for producing them MAVS, EIF2AK2, ADAR TSHR 1949/4885CHRM2 4646/4885CHRM4 3607/4885
US-10072262-B2 RIG-I ligands and methods for producing them MAVS, EIF2AK2, ADAR TSHR 1949/4885CHRM2 4646/4885CHRM4 3607/4885
US-20050020521-A1 Rna interference strands and antibody strands AGO2, NSUN3, NSUN2 TSHR 3338/4885CHRM2 4816/4885CHRM4 4805/4885
US-11136578-B2 In vivo gene silencing by chemically modified and stable siRNA SNRPE, AGO2, NSUN2 TSHR 4016/4885CHRM2 4778/4885CHRM4 4818/4885
US-10087441-B2 In vivo gene silencing by chemically modified and stable siRNA SNRPE, AGO2, NSUN2 TSHR 4016/4885CHRM2 4778/4885CHRM4 4818/4885
US-20180312841-A1 NOVEL RIG-I LIGANDS AND METHODS FOR PRODUCING THEM MAVS, EIF2AK2, DDX5 TSHR 2469/4885CHRM2 4705/4885CHRM4 3888/4885

“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.