SCHEMBL19447698

SCHEMBL19447698

CC(C)C(=O)NS(=O)(=O)C1CC1C

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 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
SCHEMBL84558 0.75 ALDH1A1 (0.38) ALDH1A1NPSR1
SCHEMBL19627413 0.72 MMP1 (0.39) ALDH1A1NPSR1
SCHEMBL20952878 0.71 CXCR1 (0.34) NPSR1
SCHEMBL19627405 0.71 MMP1 (0.41) ALDH1A1
SCHEMBL20000429 0.68 CNR2 (0.33) ALDH1A1NPSR1
SCHEMBL15423449 0.68 CA14 (0.50) ALDH1A1NPSR1
SCHEMBL10154731 0.67 ALDH1A1 (0.41) ALDH1A1NPSR1
SCHEMBL28420215 0.66 ALDH1A1 (0.44) ALDH1A1NPSR1
SCHEMBL4070679 0.66 NPSR1 (0.48) ALDH1A1NPSR1
SCHEMBL8908252 0.66 ALDH1A1 (0.40) ALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170290827-A1 INHIBITORS OF HEPATITIS C VIRUS GILEAD PHARMASSET LLC 2017-10-12 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 (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-20170290827-A1 INHIBITORS OF HEPATITIS C VIRUS HAVCR2, SLC10A1, GOT1 ALDH1A1 112/4885NPSR1 3244/4885

“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.