SCHEMBL20189771

SCHEMBL20189771

NC(=O)CCOC(=O)NCCCOCCNS(=O)(=O)c1cccc(OCC2CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DUT P33316 4/20 0.49
FBP1 P09467 1/20 0.41
TPSAB1 Q15661 1/20 0.38
NAMPT P43490 1/20 0.37
MTNR1A P48039 1/20 0.37
ALDH1A1 P00352 4/20 0.37
SLC9A3 P48764 1/20 0.36
HPGD P15428 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
HTR7 P34969 1/20 0.36
HTR6 P50406 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL20189766 0.82 DUT (0.49) DUTFBP1TPSAB1NAMPTALDH1A1
SCHEMBL21536109 0.80 DUT (0.46) DUTTPSAB1MTNR1ASLC9A3
SCHEMBL20189787 0.79 DUT (0.61) DUTFBP1NAMPTMTNR1AALDH1A1
SCHEMBL20189790 0.79 DUT (0.61) DUTFBP1TPSAB1ALDH1A1SLC9A3
SCHEMBL21536747 0.78 DUT (0.54) DUTFBP1MTNR1AALDH1A1MAPK1
SCHEMBL20190941 0.76 DUT (0.58) DUTFBP1TPSAB1ALDH1A1HTR1A
SCHEMBL21522296 0.75 DUT (0.58) DUTALDH1A1MAPK1NPSR1
SCHEMBL20189610 0.74 DUT (0.58) DUTFBP1TPSAB1ALDH1A1MAPK1
SCHEMBL21536107 0.73 DUT (0.46) DUTTPSAB1MTNR1AALDH1A1SLC9A3
SCHEMBL20191126 0.73 DUT (0.52) DUTNAMPTMTNR1AALDH1A1SMN1; SMN2

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-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
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 3/4885FBP1 616/4885TPSAB1 3072/4885
US-20190330158-A1 AMINO SULFONYL COMPOUNDS DPYD, DNPEP, DUT DUT 3/4885FBP1 616/4885TPSAB1 3072/4885

“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.