SCHEMBL523819

SCHEMBL523819

CC(C)(CO)CNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.62
PKM P14618 4/20 0.62
POLB P06746 2/20 0.62
SMN1; SMN2 Q16637 1/20 0.58
GAA P10253 6/20 0.56
KMT2A Q03164 1/20 0.56
TDP1 Q9NUW8 1/20 0.52
CA2 P00918 2/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA9 Q16790 1/20 0.51
NPSR1 Q6W5P4 1/20 0.49
DOT1L Q8TEK3 1/20 0.49
LMNA P02545 1/20 0.48
ALDH1A1 P00352 1/20 0.47

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
SCHEMBL1700076 0.83 MAPT (0.62) MAPTPKMPOLBSMN1; SMN2GAA
SCHEMBL1958428 0.81 MAPT (0.71) MAPTPKMPOLBSMN1; SMN2GAA
SCHEMBL16039236 0.81 MAPT (0.67) MAPTPKMPOLBSMN1; SMN2GAA
SCHEMBL523266 0.80 MAPT (0.51) MAPTPKMPOLBSMN1; SMN2GAA
SCHEMBL28855358 0.79 MAPT (0.58) MAPTPKMPOLBSMN1; SMN2GAA
SCHEMBL2943101 0.79 MAPT (0.55) MAPTPKMPOLBSMN1; SMN2GAA
SCHEMBL28310754 0.77 MAPT (0.62) MAPTPKMPOLBSMN1; SMN2GAA
SCHEMBL21542217 0.77 MAPT (0.73) MAPTPKMPOLBSMN1; SMN2GAA
SCHEMBL30349527 0.77 MAPT (0.73) MAPTPKMPOLBSMN1; SMN2GAA
SCHEMBL22725447 0.76 PDK1 (0.52) MAPTSMN1; SMN2GAAKMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200277291-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC. (US) 2020-09-03 US disclosed
US-20190315737-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2019-10-17 US disclosed
EP-3312178-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES AbbVie Inc. (US) 2018-04-25 EP disclosed
CN-104961771-B For treating cancer and the immune cell death inducer with autoimmune disease ABBVIE 公司 2018-02-02 CN disclosed
EP-3091017-B1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2018-01-17 EP disclosed
US-20170096424-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2017-04-06 US disclosed
EP-3091017-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES AbbVie Inc. (US) 2016-11-09 EP disclosed
US-9403822-B2 Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC. (US) 2016-08-02 US disclosed
EP-2575463-B1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2016-03-30 EP disclosed
CN-104961771-A Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC 2015-10-07 CN disclosed
US-20150246914-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBVIE INC (US) 2015-09-03 US disclosed
US-9006247-B2 Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC. (US) 2015-04-14 US disclosed
CN-102939009-B Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBVIE INC 2015-03-25 CN disclosed
EP-2575463-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES Abbvie Inc. (US) 2013-04-10 EP disclosed
CN-102939009-A Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBOTT LAB 2013-02-20 CN disclosed
US-20120028925-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2012-02-02 US disclosed
WO-2011150016-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-12-01 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 (5 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-20120028925-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 MAPT 4105/4885PKM 4645/4885POLB 1831/4885
US-20150246914-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 MAPT 4105/4885PKM 4645/4885POLB 1831/4885
US-20200277291-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 MAPT 4105/4885PKM 4645/4885POLB 1831/4885
US-20190315737-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 MAPT 4105/4885PKM 4645/4885POLB 1831/4885
US-20170096424-A1 APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE AND AUTOIMMUNE DISEASES BCL2, BAX, BCL3 MAPT 4105/4885PKM 4645/4885POLB 1831/4885

“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.