SCHEMBL17682245

SCHEMBL17682245

Cn1c(N)c(NC2CC2)c(=O)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.44
GFER P55789 1/20 0.38
KDM4E B2RXH2 10/20 0.37
ALDH1A1 P00352 5/20 0.37
GAA P10253 4/20 0.37
POLB P06746 3/20 0.37
KMT2A Q03164 8/20 0.36
MEN1 O00255 7/20 0.36
LMNA P02545 2/20 0.36
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.33
YTHDF2 Q9Y5A9 1/20 0.33
HPGD P15428 1/20 0.33
CDK1 P06493 1/20 0.33
TPI1 P60174 1/20 0.33
TYMP P19971 2/20 0.33

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
SCHEMBL9412532 0.77 KDM4E (0.51) EPHX2GFERKDM4EALDH1A1GAA
SCHEMBL31085137 0.77 EPHX2 (0.37) EPHX2GFERKDM4EALDH1A1POLB
SCHEMBL20105779 0.73 EPHX2 (0.44) EPHX2GFERKDM4EALDH1A1GAA
SCHEMBL6673604 0.72 EPHX2 (0.42) EPHX2GFERKDM4EALDH1A1GAA
SCHEMBL17314544 0.72 KDM4E (0.40) EPHX2GFERKDM4EALDH1A1GAA
SCHEMBL17314542 0.72 KDM4E (0.40) EPHX2GFERKDM4EALDH1A1GAA
SCHEMBL6886919 0.71 EPHX2 (0.41) EPHX2GFERKDM4EALDH1A1GAA
SCHEMBL17314892 0.71 EPHX2 (0.37) EPHX2GFERKDM4EALDH1A1GAA
SCHEMBL17314893 0.71 EPHX2 (0.37) EPHX2GFERKDM4EALDH1A1GAA
SCHEMBL19036786 0.70 KDM4E (0.52) EPHX2KDM4EALDH1A1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10278973-B2 Hydroxyl purine compounds and use thereof Guangdong Raynovent Biotech Co., Ltd. (CN) 2019-05-07 US disclosed
US-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF Guangdong Raynovent Biotech Co., Ltd. (CN) 2018-05-24 US disclosed
EP-3299371-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-03-28 EP disclosed
EP-3299371-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2018-03-28 EP disclosed
US-20170326149-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-11-16 US disclosed
US-20170326149-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF GUANGDONG ZHONGSHENG PHARMACEUTICAL CO., LTD (CN) 2017-11-16 US disclosed
EP-3205652-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF Medshine Discovery Inc. (CN) 2017-08-16 EP disclosed
WO-2017071606-A1 MEDICAL USE OF HYDROXYL PURINE COMPOUND 南京明德新药研发股份有限公司 2017-05-04 WO disclosed
WO-2016184312-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF 南京明德新药研发股份有限公司 2016-11-24 WO disclosed
WO-2016054971-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF 南京明德新药研发股份有限公司 2016-04-14 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 (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-20170326149-A1 HYDROXYL PURINE COMPOUNDS AND APPLICATIONS THEREOF PNP, PDE2A, PDE7A EPHX2 341/4885GFER 3639/4885KDM4E 4302/4885
US-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF PNP, PDE7A, PDE2A EPHX2 282/4885GFER 3624/4885KDM4E 3906/4885
US-10278973-B2 Hydroxyl purine compounds and use thereof PNP, PDE7A, PDE2A EPHX2 282/4885GFER 3624/4885KDM4E 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.