SCHEMBL20185593

SCHEMBL20185593

CCCC(=O)OCCC1CCOC1C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.36
DGKA P23743 1/20 0.35
PPM1B O75688 2/20 0.34
PTPN1 P18031 2/20 0.34
PPP1CC P36873 2/20 0.34
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
EPHX2 P34913 1/20 0.31
DNM1 Q05193 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
SCHEMBL20185591 0.81 ALDH1A1 (0.34) NLRP3ALDH1A1LMNA
SCHEMBL20185594 0.79 ALDH1A1 (0.43) ALDH1A1LMNAPOLBEPHX2
SCHEMBL28992210 0.74 LMNA (0.54) ALDH1A1LMNAPOLB
SCHEMBL1842580 0.74 DGKA (0.41) NLRP3DGKAPPM1BPTPN1PPP1CC
SCHEMBL28992186 0.73 NAAA (0.39) NLRP3DGKAPPM1BPTPN1PPP1CC
SCHEMBL18269637 0.73 LMNA (0.42) ALDH1A1LMNAPOLB
SCHEMBL29266732 0.73 EPHX1 (0.54) DGKALMNAPOLBEPHX2
SCHEMBL28992214 0.73 LMNA (0.49) ALDH1A1LMNAPOLBEPHX2
SCHEMBL18269659 0.73 LMNA (0.42) ALDH1A1LMNAPOLB
SCHEMBL10202271 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10618898-B2 Hydroxyl purine compounds and use thereof Guangdong Raynovent Biotech Co., Ltd. (CN) 2020-04-14 US disclosed
US-20180148451-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF Guangdong Raynovent Biotech Co., Ltd. (CN) 2018-05-31 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 (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-20180148451-A1 HYDROXYL PURINE COMPOUNDS AND USE THEREOF PNP, PDE7A, PDE2A NLRP3 305/4885DGKA 1814/4885PPM1B 334/4885
US-10618898-B2 Hydroxyl purine compounds and use thereof PNP, PDE7A, PDE2A NLRP3 305/4885DGKA 1814/4885PPM1B 334/4885

“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.