SCHEMBL20191007

SCHEMBL20191007

CC(C)COc1cc(S(=O)(=O)NCCC/C=C/CN2CCC(=O)NC2=O)ccc1F

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DUT P33316 8/20 0.48
POLB P06746 3/20 0.38
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 2/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PARG Q86W56 1/20 0.33
CYP19A1 P11511 1/20 0.33
TSHR P16473 1/20 0.33
HTR6 P50406 1/20 0.33

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
SCHEMBL20191009 1.00 DUT (0.48) DUTPOLBCYP3A4CYP2D6CYP2C19
SCHEMBL21522649 0.92 DUT (0.57) DUTPOLBCYP3A4CYP2D6CYP2C19
SCHEMBL20189322 0.92 DUT (0.57) DUTPOLBCYP3A4CYP2D6CYP2C19
SCHEMBL20190780 0.87 DUT (0.45) DUTPOLBALDH1A1LMNAMAPT
SCHEMBL20190782 0.87 DUT (0.45) DUTPOLBALDH1A1LMNAMAPT
SCHEMBL20190448 0.86 DUT (0.49) DUTPOLBCYP3A4CYP2D6CYP2C19
SCHEMBL20204683 0.83 DUT (0.44) DUTALDH1A1MAPTKMT2ATSHR
SCHEMBL20204643 0.83 CYP3A4 (0.37) DUTPOLBCYP3A4CYP2D6CYP2C19
SCHEMBL20190249 0.79 DUT (0.59) DUTPOLBCYP3A4CYP2D6CYP2C19
SCHEMBL18374651 0.79 DUT (0.55) DUT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11168059-B2 Amino sulfonyl compounds CV6 THERAPEUTICS (NI) LIMITED (GB) 2021-11-09 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
US-20190330158-A1 AMINO SULFONYL COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2019-10-31 US disclosed
WO-2018098209-A1 AMINO SULFONYL COMPOUNDS CV6 THERAPEUTICS (NI) LIMITED (GB) 2018-05-31 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 (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-11168059-B2 Amino sulfonyl compounds DPYD, DNPEP, DUT DUT 3/4885POLB 105/4885CYP3A4 3048/4885
US-20190330158-A1 AMINO SULFONYL COMPOUNDS DPYD, DNPEP, DUT DUT 3/4885POLB 105/4885CYP3A4 3048/4885

“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.