SCHEMBL9936351

SCHEMBL9936351

CS(=O)(=O)OOS(=O)(=O)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.33
TSHR P16473 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
CA13 Q8N1Q1 1/20 0.32

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
SCHEMBL2085247 0.85 CA2 (0.41) CA1CA2CA7CA13
SCHEMBL4445189 0.74 USP2 (0.54) USP2TSHRCA1CA2
SCHEMBL4245730 0.74 F2 (0.33) CA1CA2CA7CA13
SCHEMBL2572923 0.74 USP2 (0.35) USP2TSHRCA1CA2CA7
SCHEMBL2721777 0.73 CA1 (0.37) CA1CA2CA7CA13
SCHEMBL28396077 0.72 CA2 (0.56) TSHRCA1CA2CA7CA13
SCHEMBL29101966 0.72 USP2 (0.33) USP2TSHRCA1CA2CA7
SCHEMBL28116493 0.71 USP2 (0.50) USP2TSHRCA1CA2
SCHEMBL1345425 0.71 CA1 (0.35) CA1CA2CA7CA13
SCHEMBL29162625 0.70 CA1 (0.30) CA1CA2CA7CA13

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
US-8895570-B2 Purine derivatives ASTRAZENECA AB (SE) 2014-11-25 US disclosed
US-20130338174-A1 PURINE DERIVATIVES Sumitomo Pharma Co., Ltd. (JP) 2013-12-19 US disclosed
EP-2651943-A1 PURINE DERIVATIVES Astrazeneca AB (SE) 2013-10-23 EP disclosed
WO-2012080730-A1 PURINE DERIVATIVES ASTRAZENECA AB (SE) 2012-06-21 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-20130338174-A1 PURINE DERIVATIVES HPRT1, PNP, SLC29A1 USP2 4810/4885TSHR 3638/4885CA1 3916/4885

“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.