SCHEMBL25878684

SCHEMBL25878684

Cc1cc(C)c(S(=O)(=O)N[C@H](C(=O)N2C[C@H]3[C@@H]([C@H]2C)C3(C)C)C(C)(C)C)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 15/20 0.35
NR3C2 P08235 13/20 0.35
PGR P06401 12/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34
MMP8 P22894 1/20 0.34
MMP13 P45452 1/20 0.34

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
SCHEMBL25664730 0.87 CTSV (0.33)
SCHEMBL25664781 0.86 NR3C1 (0.34) NR3C1NR3C2PGRCA1CA2
SCHEMBL25880760 0.84 MMP13 (0.37) CA1CA2MMP1MMP2MMP9
SCHEMBL25878180 0.80 ALDH1A1 (0.34)
SCHEMBL25881073 0.80 ALDH1A1 (0.34)
SCHEMBL25880720 0.80 MMP13 (0.38) MMP1MMP2MMP9MMP8MMP13
SCHEMBL25881065 0.79 ALDH1A1 (0.33)
SCHEMBL25877986 0.79 SLC1A3 (0.38)
SCHEMBL25878425 0.79 CTSV (0.31)
SCHEMBL25877760 0.79 HSD11B1 (0.36) MMP1MMP2MMP9MMP13

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-20230234921-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF ASCLETIS BIOSCIENCE CO., LTD. (CN) 2023-07-27 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-20230234921-A1 INHIBITORS OF CYSTEINE PROTEASES AND METHODS OF USE THEREOF SERPINB1, CTSV, CTSE NR3C1 4510/4885NR3C2 4673/4885PGR 3840/4885

“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.