SCHEMBL17545261

SCHEMBL17545261

COC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1cc2c(cc1Br)CCN2C(C)=O

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
POLB P06746 5/20 0.59
ACLY P53396 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.53
ALDH1A1 P00352 3/20 0.53
MCL1 Q07820 1/20 0.53
LMNA P02545 1/20 0.49
TP53 P04637 1/20 0.49
GAA P10253 1/20 0.45
MAPK1 P28482 1/20 0.45
RAB9A P51151 1/20 0.45

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 0.89 POLB (0.54) MEN1KMT2APOLBSMN1; SMN2ALDH1A1
SCHEMBL17545078 0.83 RECQL (0.56) MEN1KMT2APOLBACLYSMN1; SMN2
SCHEMBL17545071 0.83 RECQL (0.56) MEN1KMT2APOLBACLYSMN1; SMN2
SCHEMBL21469186 0.81 POLB (0.45) MEN1KMT2APOLBACLYSMN1; SMN2
SCHEMBL19222298 0.80 POLB (0.47) KMT2APOLBACLYSMN1; SMN2ALDH1A1
SCHEMBL17545309 0.80 ACLY (0.50) MEN1KMT2APOLBACLYSMN1; SMN2
SCHEMBL19222362 0.80 ACLY (0.50) MEN1KMT2APOLBACLYSMN1; SMN2
SCHEMBL17545350 0.80 ACLY (0.50) MEN1KMT2APOLBACLYSMN1; SMN2
SCHEMBL17545353 0.77 ACLY (0.69) ACLYSMN1; SMN2LMNATP53GAA
SCHEMBL29707979 0.77 ACLY (0.61) MEN1KMT2AACLYALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11021469-B2 Indoline sulfonamide inhibitors of DapE and NDM-1 and use of the same LOYOLA UNIVERSITY OF CHICAGO (US) 2021-06-01 US disclosed
US-20190337931-A1 INDOLINE SULFONAMIDE INHIBITORS OF DAPE AND NDM-1 AND USE OF THE SAME LOYOLA UNIVERSITY OF CHICAGO 2019-11-07 US disclosed
EP-3180312-B1 INDOLINE SULFONAMIDE INHIBITORS OF DAPE AND NDM-1 AND USE OF THE SAME UNIV LOYOLA CHICAGO (US) 2019-10-16 EP disclosed
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
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
WO-2016025637-A1 INDOLINE SULFONAMIDE INHIBITORS OF DAPE AND NDM-1 AND USE OF THE SAME LOYOLA UNIVERSITY OF CHICAGO (US) 2016-02-18 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 (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-10385040-B2 Indoline sulfonamide inhibitors of DapE and NDM-1 and use of the same INMT, MGAM, NNMT MEN1 1541/4885KMT2A 1720/4885POLB 1517/4885
US-20190337931-A1 INDOLINE SULFONAMIDE INHIBITORS OF DAPE AND NDM-1 AND USE OF THE SAME INMT, MGAM, NNMT MEN1 1541/4885KMT2A 1720/4885POLB 1517/4885
US-11021469-B2 Indoline sulfonamide inhibitors of DapE and NDM-1 and use of the same INMT, MGAM, NNMT MEN1 1541/4885KMT2A 1720/4885POLB 1517/4885
US-20170226090-A1 INDOLINE SULFONAMIDE INHIBITORS OF DAPE AND NDM-1 AND USE OF THE SAME INMT, MGAM, NNMT MEN1 1541/4885KMT2A 1720/4885POLB 1517/4885

“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.