SCHEMBL23787015

SCHEMBL23787015

COC(=O)[C@H](NC(=O)C12CC(NS(=O)(=O)c3ccccc3)(C1)C2)C(C)(C)NC(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.36
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
ABCB1 P08183 1/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MMP13 P45452 2/20 0.32
KLK5 Q9Y337 2/20 0.32
KDM4E B2RXH2 1/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 1/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
PKM P14618 1/20 0.32
HPGD P15428 1/20 0.32
AGTR1 P30556 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL21612219 0.73 BCL2 (0.34) BCL2ALDH1A1ABCB1KLK5CA2
SCHEMBL21612220 0.73 BCL2 (0.34) BCL2ALDH1A1ABCB1KLK5CA2
SCHEMBL21612217 0.73 PTPN1 (0.35) BCL2PPARGPPARA
SCHEMBL21612213 0.70 KMT2A (0.42) ALDH1A1TSHRGAAL3MBTL1MMP13
SCHEMBL13337480 0.69 SYK (0.58) ALDH1A1TSHRKLK5LMNAMAPT
SCHEMBL13244981 0.69 SYK (0.58) ALDH1A1TSHRKLK5LMNAMAPT
SCHEMBL28459748 0.69 KLK5 (0.36) TSHRKLK5ATMPPARGPPARA
SCHEMBL21615437 0.67 CA1 (0.46) GAAMMP13KDM4ECA1HPGD
SCHEMBL24234472 0.67 SYK (0.49) ALDH1A1L3MBTL1KLK5MAPTATM
SCHEMBL21612226 0.67 CTSK (0.43) ALDH1A1KLK5MAPTHPGD

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-20210275499-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AND PHARMACEUTICAL USES THEREOF Metrion Biosciences Limited (GB) 2021-09-09 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-20210275499-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AND PHARMACEUTICAL USES THEREOF STS, SQOR, SULT2A1 BCL2 1525/4885ALDH1A1 263/4885TSHR 1788/4885

“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.