SCHEMBL20630697

SCHEMBL20630697

C#Cc1ccc2c(c1)COS2(=O)=O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TYMS P04818 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
SCHEMBL13454840 0.79 GRM5 (0.45)
SCHEMBL5485323 0.67 GPR3 (0.36)
SCHEMBL24442281 0.63 MAPT (0.56)
SCHEMBL9014737 0.62 TYMS (0.40) TYMS
SCHEMBL211099 0.61
SCHEMBL15325030 0.61
SCHEMBL207566 0.61
SCHEMBL31447514 0.61 RAB9A (0.38) TYMS
SCHEMBL571181 0.61 RAB9A (0.38) TYMS
SCHEMBL4516223 0.61 AKR1C3 (0.33) TYMS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110997658-B Triazole derivatives as hypoxia imaging agents 法国国家科研中心 2024-01-26 CN disclosed
US-11135319-B2 Compounds useful as imaging agents of hypoxia CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-10-05 US disclosed
US-11135319-B2 Compounds useful as imaging agents of hypoxia CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-10-05 US disclosed
US-20200171178-A1 COMPOUNDS USEFUL AS IMAGING AGENTS OF HYPOXIA CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2020-06-04 US disclosed
US-20200171178-A1 COMPOUNDS USEFUL AS IMAGING AGENTS OF HYPOXIA CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2020-06-04 US disclosed
CN-110997658-A Triazole derivatives as hypoxia imaging agents 法国国家科研中心 2020-04-10 CN disclosed
WO-2019008119-A1 TRIAZOLE DERIVATIVES USED AS A HYPOXIA IMAGING AGENT CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2019-01-10 WO disclosed
US-9422225-B2 Substituted phenethylamines with serotoninergic and/or norepinephrinergic activity AUSPEX PHARMACEUTICALS, INC. (US) 2016-08-23 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-11135319-B2 Compounds useful as imaging agents of hypoxia HIF1AN, HIF1A, HYOU1 TYMS 861/4885
US-20200171178-A1 COMPOUNDS USEFUL AS IMAGING AGENTS OF HYPOXIA HIF1AN, HIF1A, HYOU1 TYMS 861/4885

“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.