SCHEMBL19987782

SCHEMBL19987782

Cc1cc(CC2CCCC(COS(C)(=O)=O)C2)on1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 8/20 0.35
CHRNB2 P17787 3/20 0.33
CHRNA5 P30532 2/20 0.33
CHRNB4 P30926 2/20 0.33
CHRNA3 P32297 2/20 0.33
VHL P40337 2/20 0.33
EPHX2 P34913 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CDK2 P24941 1/20 0.30
CHRNA4 P43681 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
SCHEMBL18256182 0.85 PARG (0.35) PARGCHRNB2CHRNA5CHRNB4CHRNA3
SCHEMBL28540594 0.81 PARG (0.35) PARGVHLEPHX2MEN1KMT2A
SCHEMBL28540592 0.81 PARG (0.35) PARGCHRNB2CHRNA5CHRNB4CHRNA3
SCHEMBL1320181 0.78 VHL (0.41) PARGCHRNB2CHRNA5CHRNB4CHRNA3
SCHEMBL1320408 0.75 VHL (0.41) PARGCHRNB2CHRNA5CHRNB4CHRNA3
SCHEMBL18256114 0.75 VHL (0.39) PARGCHRNB2CHRNB4CHRNA3VHL
SCHEMBL1941686 0.71 KMT2A (0.51) VHLEPHX2MEN1KMT2A
SCHEMBL18256181 0.69 VHL (0.38) PARGCHRNB2CHRNB4CHRNA3VHL
SCHEMBL18256149 0.68 KMT2A (0.41) VHLEPHX2MEN1KMT2A
SCHEMBL121125 0.68 LMNA (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107709323-B Hydroxyl purine compound and application thereof 广东众生睿创生物科技有限公司 2020-11-20 CN disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20180140607-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF PNP, PDE7A, PDE2A PARG 1744/4885CHRNB2 1128/4885CHRNA5 1827/4885
US-10278973-B2 Hydroxyl purine compounds and use thereof PNP, PDE7A, PDE2A PARG 1744/4885CHRNB2 1128/4885CHRNA5 1827/4885

“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.