SCHEMBL667613

SCHEMBL667613

COc1ccc(C(OC[C@H]2O[C@@H](n3ccc(NC(C)=O)nc3=O)[C@H](OC)[C@@H]2OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TYMP P19971 6/20 0.37
P2RY6 Q15077 5/20 0.34
P2RY14 Q15391 2/20 0.34
NT5E P21589 1/20 0.33
P2RY2 P41231 2/20 0.33
P2RY4 P51582 2/20 0.33
GAPDH P04406 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
SCHEMBL31229956 1.00 TYMP (0.37) TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL24878606 1.00 TYMP (0.37) TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL26535949 1.00 TYMP (0.37) TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL29195406 1.00 TYMP (0.37) TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL13715722 0.96 TYMP (0.37) TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL3915198 0.96 TYMP (0.37) TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL6928627 0.95 P2RY6 (0.40) TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL6518721 0.94 TYMP (0.35) TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL16214972 0.94 TYMP (0.35) TYMPP2RY6P2RY14NT5EP2RY2
SCHEMBL668064 0.94 TYMP (0.35) TYMPP2RY6P2RY14NT5EP2RY2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114206389-A Multivalent ligand clusters for targeted delivery of therapeutic agents 有丝分裂疗法有限责任公司 2022-03-18 CN disclosed
EP-2647713-B1 MODIFIED SINGLE-STRAND POLYNUCLEOTIDE DAIICHI SANKYO CO LTD (JP) 2018-02-21 EP disclosed
US-9885036-B2 Double-stranded polynucleotide DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-02-06 US disclosed
EP-2899278-A1 iRNA agents targeting VEGF Alnylam Pharmaceuticals Inc. (US) 2015-07-29 EP disclosed
US-8987226-B2 Modified single-stranded polynucleotides DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-03-24 US disclosed
US-20150011608-A1 iRNA Agents Targeting VEGF ALNYLAM PHARMACEUTICALS, INC. 2015-01-08 US disclosed
EP-2636739-B1 iRNA agents targeting VEGF ALNYLAM PHARMACEUTICALS INC (US) 2014-12-10 EP disclosed
EP-2647713-A1 MODIFIED SINGLE-STRAND POLYNUCLEOTIDE DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-10-09 EP disclosed
US-20130253038-A1 Modified Single-Stranded Polynucleotide DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-09-26 US disclosed
EP-2636739-A1 iRNA agents targeting VEGF Alnylam Pharmaceuticals Inc. (US) 2013-09-11 EP disclosed
US-20120220649-A1 MODIFIED DOUBLE-STRANDED POLYNUCLEOTIDE DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-08-30 US disclosed
US-20120045461-A1 Compositions and Methods for Inducing an Immune Response in a Mammal and Methods of Avoiding an Immune Response to Oligonucleotide Agents Such as Short Interfering RNAs ALNYLAM PHARMACEUTICALS, INC. 2012-02-23 US disclosed
US-20110224282-A1 iRNA Agents Targeting VEGF ALNYLAM PHARMACEUTICALS, INC. 2011-09-15 US disclosed
EP-2365077-A1 iRNA agents targeting VEGF Alnylam Pharmaceuticals, Inc. (US) 2011-09-14 EP disclosed
US-8003619-B2 Method of stimulating an immune response and inhibiting expression of a gene using an oligonucleotide ALNYLAM PHARMACEUTICALS, INC. (US) 2011-08-23 US disclosed
US-20110152353-A1 DOUBLE-STRANDED POLYNUCLEOTIDE DAIICHI SANKYO COMPANY, LIMITED 2011-06-23 US disclosed
US-7947659-B2 iRNA agents targeting VEGF ALNYLAM PHARMACEUTICALS, INC. (US) 2011-05-24 US disclosed
US-7919473-B2 IRNA agents targeting VEGF ALNYLAM PHARMACEUTICALS, INC. (US) 2011-04-05 US disclosed
US-20060223770-A1 IRNA agents targeting VEGF ALNYLAM EUROPE AG (DE) 2006-10-05 US disclosed
US-20060094032-A1 iRNA agents targeting VEGF ALNYLAM PHARMACEUTICALS, INC. 2006-05-04 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 (5 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-20060094032-A1 iRNA agents targeting VEGF KDR, FLT4, SNRPE TYMP 1464/4885P2RY6 4719/4885P2RY14 4836/4885
US-20120220649-A1 MODIFIED DOUBLE-STRANDED POLYNUCLEOTIDE POLM, POLN, PNKP TYMP 15/4885P2RY6 1762/4885P2RY14 2450/4885
US-20110152353-A1 DOUBLE-STRANDED POLYNUCLEOTIDE NSUN2, TRDMT1, POLRMT TYMP 151/4885P2RY6 3959/4885P2RY14 4177/4885
US-20060223770-A1 IRNA agents targeting VEGF KDR, FLT4, SNRPE TYMP 1464/4885P2RY6 4719/4885P2RY14 4836/4885
US-20110224282-A1 iRNA Agents Targeting VEGF KDR, FLT4, SNRPE TYMP 1464/4885P2RY6 4719/4885P2RY14 4836/4885

“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.