SCHEMBL21886085

SCHEMBL21886085

CC(C)NS(=O)(=O)Cc1ncc(F)cn1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
APLNR P35414 14/20 0.42
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
SIGMAR1 Q99720 1/20 0.32
ALDH1A1 P00352 2/20 0.32
ACACB O00763 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
SCHEMBL21886081 0.84 APLNR (0.39) APLNRCA1CA2ALDH1A1
SCHEMBL21886083 0.83 NPSR1 (0.33) CA1CA2ALDH1A1
SCHEMBL21885987 0.80 KMT2A (0.36) ALDH1A1
SCHEMBL21886084 0.79 APLNR (0.39) APLNRCA1CA2ALDH1A1
SCHEMBL13234055 0.71 KMT2A (0.49) CA1CA2ALDH1A1
SCHEMBL23026154 0.70 APLNR (0.50) APLNRCA1CA2
SCHEMBL28517694 0.69 APLNR (0.46) APLNR
SCHEMBL21886024 0.68 ALDH1A1 (0.37) ALDH1A1
SCHEMBL21163177 0.68 ALDH1A1 (0.37) ALDH1A1
SCHEMBL21163169 0.68 MEN1 (0.31) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230165854-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY SHOUTI INC. 2023-06-01 US disclosed
WO-2020073011-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY ANNAPURNA BIO, INC. (US) 2020-04-09 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 (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-20230165854-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY APLNR, AGTR1, AGTR2 APLNR 1/4885CA1 3105/4885CA2 952/4885

“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.