SCHEMBL20364686

SCHEMBL20364686

CC(C)S(=O)(=O)c1ccccc1Oc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 8/20 0.48
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PTGS2 P35354 1/20 0.44
RIPK1 Q13546 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.41
HTR6 P50406 1/20 0.40
CTNNB1 P35222 1/20 0.40
TSPO P30536 1/20 0.39
PTGS1 P23219 1/20 0.39

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
SCHEMBL13588814 0.79 HTR6 (0.56) L3MBTL1KMT2APOLBHTR6
SCHEMBL502864 0.79 CASP1 (0.50) CASP1LMNAPTGS2RIPK1GAA
SCHEMBL146565 0.79 CASP1 (0.50) CASP1LMNAPTGS2RIPK1GAA
SCHEMBL13588835 0.78 IRAK4 (0.44) LMNAHTR6
Ammonia Solution, Strong SCHEMBL502557 0.77 CASP1 (0.49) CASP1LMNAPTGS2RIPK1GAA
SCHEMBL11599660 0.77 CASP1 (0.49) CASP1LMNAPTGS2RIPK1GAA
SCHEMBL18184670 0.76 RIPK1 (0.47) CASP1LMNAL3MBTL1PTGS2RIPK1
SCHEMBL32661421 0.76 CASP1 (0.51) CASP1LMNAL3MBTL1PTGS2RIPK1
SCHEMBL569758 0.76 SOS1 (0.55) CASP1LMNAPTGS2GAAKMT2A
SCHEMBL158361 0.76 CASP1 (0.51) CASP1LMNAL3MBTL1PTGS2RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220411426-A1 SUBSTRATE SELECTIVE INHIBITORS OF INSULIN-DEGRADING ENZYME (IDE) AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2022-12-29 US disclosed
US-11040976-B2 Substrate selective inhibitors of insulin-degrading enzyme (IDE) and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2021-06-22 US disclosed
US-20190016723-A9 SUBSTRATE SELECTIVE INHIBITORS OF INSULIN-DEGRADING ENZYME (IDE) AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-01-17 US disclosed
US-20180194768-A1 SUBSTRATE SELECTIVE INHIBITORS OF INSULIN DEGRADING ENZYME (IDE) AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2018-07-12 US disclosed
US-20180194768-A1 SUBSTRATE SELECTIVE INHIBITORS OF INSULIN DEGRADING ENZYME (IDE) AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2018-07-12 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 (4 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-20180194768-A1 SUBSTRATE SELECTIVE INHIBITORS OF INSULIN DEGRADING ENZYME (IDE) AND USES THEREOF IDE, SI, GPR119 CASP1 1011/4885LMNA 1974/4885L3MBTL1 3519/4885
US-20220411426-A1 SUBSTRATE SELECTIVE INHIBITORS OF INSULIN-DEGRADING ENZYME (IDE) AND USES THEREOF IDE, SI, GPR119 CASP1 1089/4885LMNA 2054/4885L3MBTL1 3285/4885
US-20190016723-A9 SUBSTRATE SELECTIVE INHIBITORS OF INSULIN-DEGRADING ENZYME (IDE) AND USES THEREOF IDE, SI, GPR119 CASP1 1101/4885LMNA 2131/4885L3MBTL1 3211/4885
US-11040976-B2 Substrate selective inhibitors of insulin-degrading enzyme (IDE) and uses thereof IDE, SI, GPR119 CASP1 1101/4885LMNA 2131/4885L3MBTL1 3211/4885

“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.