SCHEMBL21536071

SCHEMBL21536071

O=C1CN(Cc2cnc(CNS(=O)(=O)c3cccc(OCC(F)F)c3)s2)C(=O)N1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DUT P33316 14/20 0.43
ROCK2 O75116 1/20 0.34
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
BACE1 P56817 1/20 0.32
ALDH1A1 P00352 1/20 0.32
FBP1 P09467 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL21536732 0.93 DUT (0.43) DUTROCK2BACE1ALDH1A1FBP1
SCHEMBL21536066 0.85 DUT (0.40) DUTALDH1A1
SCHEMBL21536566 0.84 DUT (0.45) DUTROCK2BACE1ALDH1A1L3MBTL1
SCHEMBL21536607 0.84 DUT (0.42) DUTBACE1ALDH1A1
SCHEMBL21536604 0.84 DUT (0.45) DUTROCK2BACE1ALDH1A1L3MBTL1
SCHEMBL21536601 0.84 DUT (0.45) DUTROCK2ALDH1A1
SCHEMBL21536714 0.83 DUT (0.49) DUTALDH1A1
SCHEMBL21536064 0.83 DUT (0.44) DUTROCK2BACE1L3MBTL1
SCHEMBL21536724 0.83 DUT (0.45) DUTROCK2BACE1ALDH1A1L3MBTL1
SCHEMBL21536572 0.83 DUT (0.45) DUTROCK2BACE1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230263773-A1 COMBINATION THERAPY WITH DEOXYURIDINE TRIPHOSPHATASE INHIBITORS CV6 THERAPEUTICS (NI) LIMITED (GB) 2023-08-24 US disclosed
US-11168059-B2 Amino sulfonyl compounds CV6 THERAPEUTICS (NI) LIMITED (GB) 2021-11-09 US disclosed
US-20190330158-A1 AMINO SULFONYL COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2019-10-31 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 (3 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-20230263773-A1 COMBINATION THERAPY WITH DEOXYURIDINE TRIPHOSPHATASE INHIBITORS TYMP, DUT, TYMS DUT 2/4885ROCK2 3018/4885HCRTR1 4727/4885
US-11168059-B2 Amino sulfonyl compounds DPYD, DNPEP, DUT DUT 3/4885ROCK2 4782/4885HCRTR1 4783/4885
US-20190330158-A1 AMINO SULFONYL COMPOUNDS DPYD, DNPEP, DUT DUT 3/4885ROCK2 4782/4885HCRTR1 4783/4885

“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.