SCHEMBL21885829

SCHEMBL21885829

CC(C)NS(=O)(=O)N1CCC(O)CC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.38
MAPK1 P28482 1/20 0.37
ATM Q13315 1/20 0.37
EPHX2 P34913 2/20 0.36
TSHR P16473 4/20 0.35
TP53 P04637 1/20 0.33
MMP1 P03956 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GAA P10253 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL20942743 0.89 TSHR (0.40) HSD11B1MAPK1ATMEPHX2TSHR
SCHEMBL25537327 0.82 MEN1 (0.44) EPHX2TSHRL3MBTL1MEN1KMT2A
SCHEMBL23464924 0.81 KMT2A (0.38) TSHRL3MBTL1GAAMEN1KMT2A
SCHEMBL2430641 0.81 SMYD3 (0.33) EPHX2TSHRTP53MMP1
SCHEMBL8084486 0.79 GAA (0.39) TSHRL3MBTL1GAAMEN1KMT2A
SCHEMBL8044173 0.79 FKBP1A (0.41) TSHRL3MBTL1GAAKMT2AALDH1A1
SCHEMBL12765367 0.78 MAPK1 (0.40) HSD11B1MAPK1ATMTSHRTP53
SCHEMBL13956959 0.77 FKBP1A (0.44) TSHRL3MBTL1GAAKMT2A
SCHEMBL7920915 0.74 POLB (0.37) ATMTSHRL3MBTL1GAAMEN1
SCHEMBL22991258 0.74 EPHX2 (0.50) HSD11B1MAPK1ATMEPHX2MEN1

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 4 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
US-20230165854-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY SHOUTI INC. 2023-06-01 US disclosed
US-20220125787-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY ANNAPURNA BIO, INC. 2022-04-28 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 (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-20220125787-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY APLNR, AGTR1, AGTR2 HSD11B1 1109/4885MAPK1 1659/4885ATM 3228/4885
US-20230165854-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH APJ RECEPTOR ACTIVITY APLNR, AGTR1, AGTR2 HSD11B1 1109/4885MAPK1 1659/4885ATM 3228/4885

“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.