SCHEMBL20182571

SCHEMBL20182571

Cc1noc(C)c1Cn1c(=O)c2c(ncn2CC2CCCC2)n(C)c1=O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 9/20 0.47
KMT2A Q03164 2/20 0.47
TAS2R8 Q9NYW2 3/20 0.43
PARG Q86W56 2/20 0.42
POLB P06746 1/20 0.40
HIF1A Q16665 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
PDE1C Q14123 1/20 0.38

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
SCHEMBL18255894 0.96 TRPA1 (0.48) TRPA1KMT2APARGPOLBHIF1A
SCHEMBL20182687 0.84 TRPA1 (0.44) TRPA1KMT2APARGPOLBHIF1A
SCHEMBL18256127 0.81 ADORA2B (0.54) KMT2APOLBRXFP1
SCHEMBL20182665 0.77 TRPA1 (0.44) TRPA1KMT2APARGPOLBHIF1A
SCHEMBL18256137 0.77 KMT2A (0.66) KMT2APOLBRXFP1
SCHEMBL18256065 0.76 KMT2A (0.64) KMT2ARXFP1
SCHEMBL18256106 0.76 TRPA1 (0.44) TRPA1KMT2APARGPOLBHIF1A
SCHEMBL18256053 0.75 TRPA1 (0.44) TRPA1KMT2APARGPOLBHIF1A
SCHEMBL18256060 0.75 KMT2A (0.66) KMT2APOLBRXFP1
SCHEMBL20205938 0.74 KMT2A (0.48) TRPA1KMT2APOLBHIF1ARXFP1

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-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

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 TRPA1 2926/4885KMT2A 3576/4885TAS2R8 3324/4885
US-10278973-B2 Hydroxyl purine compounds and use thereof PNP, PDE7A, PDE2A TRPA1 2926/4885KMT2A 3576/4885TAS2R8 3324/4885

“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.