SCHEMBL9459285

SCHEMBL9459285

COc1cc(OC)nc(OC(C(=O)O)c2ccccc2)n1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EDNRB P24530 17/20 0.59
EDNRA P25101 17/20 0.59
PPARA Q07869 1/20 0.48

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
SCHEMBL12095204 1.00 EDNRB (0.59) EDNRBEDNRAPPARA
SCHEMBL14298981 0.90 EDNRB (0.54) EDNRBEDNRA
SCHEMBL9459527 0.88 EDNRB (0.53) EDNRBEDNRA
SCHEMBL12096276 0.88 EDNRB (0.53) EDNRBEDNRA
SCHEMBL14244959 0.87 EDNRB (0.49) EDNRBEDNRA
SCHEMBL9723480 0.86 PPARA (0.48) EDNRBEDNRAPPARA
SCHEMBL12095220 0.84 EDNRB (0.49) EDNRBEDNRA
SCHEMBL12095212 0.83 EDNRB (0.49) EDNRBEDNRA
SCHEMBL9755161 0.82 EDNRB (0.47) EDNRBEDNRA
SCHEMBL9723559 0.81 EDNRB (0.55) EDNRBEDNRAPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9573907-B2 2, 4-pyrimidine derivatives and use thereof SNU R&DB FOUNDATION (KR) 2017-02-21 US claimed
US-20120322802-A1 NOVEL 2, 4-PYRIMIDINE DERIVATIVES AND USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-12-20 US claimed
EP-2497768-A2 NOVEL 2, 4-PYRIMIDINE DERIVATIVES AND USE THEREOF SNU R&DB Foundation (KR) 2012-09-12 EP claimed
JP-1301668-A None JP disclosed
US-9573907-B2 2, 4-pyrimidine derivatives and use thereof SNU R&DB FOUNDATION (KR) 2017-02-21 US disclosed
US-9573907-B2 2, 4-pyrimidine derivatives and use thereof SNU R&DB FOUNDATION (KR) 2017-02-21 US disclosed
US-9573907-B2 2, 4-pyrimidine derivatives and use thereof SNU R&DB FOUNDATION (KR) 2017-02-21 US disclosed
EP-2497768-B1 NOVEL 2, 4-PYRIMIDINE DERIVATIVES AND USE THEREOF SNU R&DB FOUNDATION (KR) 2016-04-20 EP disclosed
US-20120322802-A1 NOVEL 2, 4-PYRIMIDINE DERIVATIVES AND USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-12-20 US disclosed
US-20120322802-A1 NOVEL 2, 4-PYRIMIDINE DERIVATIVES AND USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-12-20 US disclosed
US-20120322802-A1 NOVEL 2, 4-PYRIMIDINE DERIVATIVES AND USE THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-12-20 US disclosed
EP-2497768-A2 NOVEL 2, 4-PYRIMIDINE DERIVATIVES AND USE THEREOF SNU R&DB Foundation (KR) 2012-09-12 EP disclosed
US-5270289-A Herbicidal dimethoxy pyrimidinyloxy-fluorinated acids and salts SCHERING AKTIENGESELLSCHAFT (DE) 1993-12-14 US disclosed
US-5139563-A HERBICIDAL COMPOUNDS SHELL RESEARCH LIMITED (GB) 1992-08-18 US disclosed
EP-0409368-A2 Substituted alfa pyrimidinyloxy carboxylic acid derivatives, process for their preparation and their use as an agent with herbicidal, fungicidal and plantgrowth regulating activity SCHERING AKTIENGESELLSCHAFT (DE) 1991-01-23 EP disclosed
EP-0400741-A1 Herbicidal compounds SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1990-12-05 EP disclosed
JP-H01301668-A MANDELIC ACID DERIVATIVE AND HERBICIDE KUMIAI CHEM IND CO LTD 1989-12-05 JP 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-20120322802-A1 NOVEL 2, 4-PYRIMIDINE DERIVATIVES AND USE THEREOF LY96, AIMP1, NLRP1 EDNRB 4586/4885EDNRA 4633/4885PPARA 3906/4885

“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.