SCHEMBL20702575

SCHEMBL20702575

N#Cc1cn(C[C@H](O)C(=O)O)cn1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
CPB2 Q96IY4 4/20 0.33
TBXAS1 P24557 2/20 0.33
CPB1 P15086 2/20 0.33
OR51E2 Q9H255 1/20 0.31
KMO O15229 1/20 0.31
PTPRA P18433 1/20 0.31

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
SCHEMBL23118112 1.00 ALDH1A1 (0.37) ALDH1A1CPB2TBXAS1CPB1OR51E2
SCHEMBL23118113 1.00 ALDH1A1 (0.37) ALDH1A1CPB2TBXAS1CPB1OR51E2
SCHEMBL23139176 0.81 KMT2A (0.36) ALDH1A1CPB2CPB1
SCHEMBL4298196 0.77 ALDH1A1 (0.39) ALDH1A1
SCHEMBL20713602 0.75 MEN1 (0.30) ALDH1A1
SCHEMBL23118151 0.69 ALDH1A1 (0.37) ALDH1A1OR51E2KMOPTPRA
SCHEMBL23118092 0.69 GABRD (0.34) ALDH1A1OR51E2KMOPTPRA
SCHEMBL23118091 0.69 GABRD (0.34) ALDH1A1OR51E2KMOPTPRA
SCHEMBL23118150 0.69 ALDH1A1 (0.37) ALDH1A1OR51E2KMOPTPRA
SCHEMBL24329784 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111356680-B Selective inhibitors of NLRP3 inflammasome 诺瑟拉有限公司 2023-11-28 CN disclosed
EP-3661921-B1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NODTHERA LTD (GB) 2023-10-18 EP disclosed
US-20210087147-A1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NodThera Limited (GB) 2021-03-25 US disclosed
CN-111356680-A Selective inhibitors of NLRP3inflammasome 诺瑟拉有限公司 2020-06-30 CN disclosed
EP-3661921-A1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME Nodthera Limited (GB) 2020-06-10 EP disclosed
WO-2019025467-A1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NodThera Limited (GB) 2019-02-07 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 (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-20210087147-A1 SELECTIVE INHIBITORS OF NLRP3 INFLAMMASOME NLRP3, NOD1, NLRP1 ALDH1A1 961/4885CPB2 3315/4885TBXAS1 403/4885

“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.