SCHEMBL19222298

SCHEMBL19222298

COC(=O)[C@H](CCc1ccccc1)NS(=O)(=O)c1cc2c(cc1Cl)CCN2C(C)=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 2/20 0.46
MCL1 Q07820 1/20 0.46
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
CCR10 P46092 1/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
LMNA P02545 1/20 0.44
PKM P14618 1/20 0.44
KMT2A Q03164 1/20 0.44
RAB9A P51151 1/20 0.44
TRIM24 O15164 2/20 0.43
ACLY P53396 1/20 0.42

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
SCHEMBL17545216 0.91 POLB (0.54) POLBSMN1; SMN2ALDH1A1MCL1GAA
SCHEMBL17545261 0.80 MEN1 (0.61) POLBSMN1; SMN2ALDH1A1MCL1GAA
SCHEMBL17545080 0.78 KMT2A (0.46) POLBSMN1; SMN2ALDH1A1GAAMAPK1
SCHEMBL17545362 0.78 KMT2A (0.46) POLBSMN1; SMN2ALDH1A1GAAMAPK1
SCHEMBL29707960 0.75 NOTUM (0.51) LMNAPKMKMT2ATRIM24ACLY
SCHEMBL15882573 0.75 NOTUM (0.51) LMNAPKMKMT2ATRIM24ACLY
SCHEMBL17545078 0.74 RECQL (0.56) POLBSMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL17545071 0.74 RECQL (0.56) POLBSMN1; SMN2ALDH1A1KMT2ARAB9A
SCHEMBL21549607 0.73 ALDH1A1 (0.46) POLBSMN1; SMN2ALDH1A1GAATP53
SCHEMBL18391780 0.73 TP53 (0.49) POLBSMN1; SMN2ALDH1A1GAAMAPK1

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-10385040-B2 Indoline sulfonamide inhibitors of DapE and NDM-1 and use of the same LOYOLA UNIVERSITY OF CHICAGO (US) 2019-08-20 US disclosed
US-20170226090-A1 INDOLINE SULFONAMIDE INHIBITORS OF DAPE AND NDM-1 AND USE OF THE SAME BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2017-08-10 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 (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-10385040-B2 Indoline sulfonamide inhibitors of DapE and NDM-1 and use of the same INMT, MGAM, NNMT POLB 1517/4885SMN1; SMN2 1800/4885ALDH1A1 1200/4885
US-20170226090-A1 INDOLINE SULFONAMIDE INHIBITORS OF DAPE AND NDM-1 AND USE OF THE SAME INMT, MGAM, NNMT POLB 1517/4885SMN1; SMN2 1800/4885ALDH1A1 1200/4885

“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.