SCHEMBL7074820

SCHEMBL7074820

NS(=O)(=O)c1ccc(OCc2cccnc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 12/20 0.68
CA12 O43570 12/20 0.68
CA9 Q16790 12/20 0.68
CA1 P00915 11/20 0.68
CA7 P43166 7/20 0.68
CA4 P22748 1/20 0.68
CA5A P35218 1/20 0.68
CA5B Q9Y2D0 1/20 0.68
ADAMTS4 O75173 1/20 0.53
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
KMT2A Q03164 1/20 0.52
IKBKB O14920 1/20 0.51
NAMPT P43490 1/20 0.50
MAPK1 P28482 1/20 0.50

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
SCHEMBL3366231 0.85 CA2 (0.59) CA2CA12CA9CA1CA7
SCHEMBL28048524 0.84 MAPK1 (0.64) MEN1ALDH1A1KMT2AIKBKBMAPK1
SCHEMBL8760665 0.81 CA12 (1.00) CA2CA12CA9CA1CA7
SCHEMBL12749870 0.80 CA2 (0.52) CA2CA12CA9CA1CA7
SCHEMBL30354931 0.80 MAOB (0.62) MEN1KMT2AMAPK1
SCHEMBL3761776 0.80 MAOB (0.62) MEN1KMT2AMAPK1
SCHEMBL7311175 0.77 MAPK1 (0.65) MEN1KMT2AIKBKBMAPK1
SCHEMBL23488238 0.77 PARP10 (0.68) MEN1KMT2AMAPK1
SCHEMBL4008207 0.77 MAPT (0.74) CA2CA12CA9CA1CA7
SCHEMBL8881389 0.76 HTT (0.62) KDM4EMEN1ALDH1A1KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12195472-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2025-01-14 US disclosed
US-20230039309-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-02-09 US disclosed
US-11208415-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2021-12-28 US disclosed
CN-106456602-B Substituted indole MCL-1 inhibitors 范德比尔特大学 2020-11-24 CN disclosed
EP-3122353-B1 SUBSTITUTED INDOLE MCL-1 INHIBITORS UNIV VANDERBILT (US) 2020-10-28 EP disclosed
US-20200140447-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2020-05-07 US disclosed
US-20170174689-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2017-06-22 US disclosed
EP-3122353-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS Vanderbilt University (US) 2017-02-01 EP disclosed
WO-2015148854-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY (US) 2015-10-01 WO disclosed
US-20030158186-A1 Compositions and methods for treating heart failure CYTOKINETICS, INCORPORATED 2003-08-21 US disclosed
WO-2003059265-A2 COMPOSITIONS AND METHODS FOR TREATING HEART FAILURE CYTOKINETICS, INC. (US) 2003-07-24 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 (6 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-20200140447-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL3 CA2 4564/4885CA12 4753/4885CA9 4823/4885
US-20230039309-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL3 CA2 4564/4885CA12 4753/4885CA9 4823/4885
US-12195472-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL3 CA2 4564/4885CA12 4753/4885CA9 4823/4885
US-20170174689-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL3 CA2 4564/4885CA12 4753/4885CA9 4823/4885
US-11208415-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL3 CA2 4564/4885CA12 4753/4885CA9 4823/4885
US-20030158186-A1 Compositions and methods for treating heart failure MYH2, TNNI3, MYLK2 CA2 156/4885CA12 2830/4885CA9 3206/4885

“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.