SCHEMBL20189790

SCHEMBL20189790

NCCOCCCNS(=O)(=O)c1cccc(OCC2CC2)c1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DUT P33316 6/20 0.61
ALDH1A1 P00352 2/20 0.45
TSHR P16473 1/20 0.45
TPSAB1 Q15661 1/20 0.43
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40
HTR7 P34969 1/20 0.40
HTR6 P50406 1/20 0.40
SLC9A3 P48764 1/20 0.40
FBP1 P09467 1/20 0.40

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
SCHEMBL20189787 0.89 DUT (0.61) DUTALDH1A1TSHRHTR1ADRD2
SCHEMBL21522296 0.86 DUT (0.58) DUTALDH1A1TSHR
SCHEMBL20190941 0.85 DUT (0.58) DUTALDH1A1TSHRTPSAB1HTR1A
SCHEMBL20189610 0.85 DUT (0.58) DUTALDH1A1TSHRTPSAB1HTR1A
SCHEMBL1409637 0.83 DUT (0.65) DUTALDH1A1TSHRHTR1ADRD2
SCHEMBL21690361 0.82 DUT (0.64) DUTALDH1A1TSHRHTR1ADRD2
SCHEMBL21536747 0.81 DUT (0.54) DUTALDH1A1TSHRFBP1
SCHEMBL20188167 0.81 DUT (0.57) DUTALDH1A1HTR1ADRD2HTR7
SCHEMBL20189757 0.80 DUT (0.59) DUTALDH1A1TSHRHTR1ADRD2
SCHEMBL20190259 0.79 DUT (0.58) DUTALDH1A1TSHRHTR1ADRD2

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 6 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
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 3/4885ALDH1A1 2924/4885TSHR 4510/4885
US-20190330158-A1 AMINO SULFONYL COMPOUNDS DPYD, DNPEP, DUT DUT 3/4885ALDH1A1 2924/4885TSHR 4510/4885

“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.