SCHEMBL855693

SCHEMBL855693

CC(C)(C)CC1CCC(=O)N1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.35
LMNA P02545 1/20 0.33
KCNA5 P22460 2/20 0.33
IRAK4 Q9NWZ3 1/20 0.32
CTSD P07339 1/20 0.32
CD274 Q9NZQ7 3/20 0.32
PDCD1LG2 Q9BQ51 2/20 0.32
PDK2 Q15119 3/20 0.31
PDCD1 Q15116 1/20 0.30

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
SCHEMBL11988217 1.00 PLG (0.35) PLGLMNAKCNA5IRAK4CTSD
SCHEMBL13483942 1.00 PLG (0.35) PLGLMNAKCNA5IRAK4CTSD
SCHEMBL23119293 0.88 PLG (0.33) PLGIRAK4CTSDCD274PDCD1LG2
SCHEMBL24954882 0.82 LMNA (0.31) LMNAKCNA5IRAK4CTSDCD274
SCHEMBL21122218 0.80 PLG (0.38) PLGLMNAKCNA5IRAK4CTSD
SCHEMBL24954673 0.80 LMNA (0.33) LMNACD274PDCD1LG2
SCHEMBL23557637 0.76 CD274 (0.39) CD274PDCD1LG2PDCD1
SCHEMBL24004302 0.76 CD274 (0.39) CD274PDCD1LG2PDCD1
SCHEMBL23375009 0.76 CD274 (0.39) CD274PDCD1LG2PDCD1
SCHEMBL11917921 0.76

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12018015-B2 Methods and compositions for targeting PD-L1 ALIGOS THERAPEUTICS, INC. (US) 2024-06-25 US disclosed
US-20230137567-A1 IMMUNOMODULATING TRIFLUOROMETHYL-AMINAL AZALIDES ZOETIS SERVICES LLC 2023-05-04 US disclosed
US-20230031213-A1 METHODS AND COMPOSITIONS FOR TARGETING PD-L1 ALIGOS THERAPEUTICS, INC. 2023-02-02 US disclosed
US-20220389020-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2022-12-08 US disclosed
WO-2020156323-A1 IMMUNOMODULATORS, COMPOSITIONS AND METHODS THEREOF BETTA PHARMACEUTICALS CO., LTD (CN) 2020-08-06 WO disclosed
WO-2019238817-A1 BIFUNCTIONAL MOLECULES FOR TARGETING RPN11 UNIVERSITY OF DUNDEE (GB) 2019-12-19 WO disclosed
US-20180066081-A1 SUBSTITUTED CYCLIC ETHER POLYMERS AND CONJUGATES AND USES THEREOF PESAVENTO, Russell P. 2018-03-08 US disclosed
US-20170283424-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2017-10-05 US disclosed
US-20170283424-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2017-10-05 US disclosed
US-20160176865-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2016-06-23 US disclosed
US-20130261117-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2013-10-03 US disclosed
US-8470818-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2013-06-25 US disclosed
US-20120190665-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2012-07-26 US disclosed
US-8143271-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2012-03-27 US disclosed
US-8143271-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2012-03-27 US disclosed
US-20120053177-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2012-03-01 US disclosed
US-20120022098-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2012-01-26 US disclosed
US-20110059963-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON, INC. 2011-03-10 US disclosed
US-20110059963-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON, INC. 2011-03-10 US disclosed
US-7863288-B2 protein kinase modulators such as Propane-1-sulfonic acid [2,4-difluoro-3-(5-ethoxy-1H-pyrrolo[1,3-b]pyridine-3-carbonyl)-phenyl]-amide, used to regulate signal transduction cascades, involved in the control of physiological functions including cellular growth and proliferation; anticarcinogenic agents PLEXXIKON, INC. (US) 2011-01-04 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 (12 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-20220389020-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK1, JAK2, JAK3 PLG 3301/4885LMNA 4756/4885KCNA5 4413/4885
US-20120190665-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK1, JAK2, JAK3 PLG 3301/4885LMNA 4756/4885KCNA5 4413/4885
US-20180066081-A1 SUBSTITUTED CYCLIC ETHER POLYMERS AND CONJUGATES AND USES THEREOF MALT1, PAICS, GNE PLG 1710/4885LMNA 2253/4885KCNA5 3447/4885
US-20120053177-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 PLG 2560/4885LMNA 2202/4885KCNA5 4086/4885
US-20120022098-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 PLG 2560/4885LMNA 2202/4885KCNA5 4086/4885
US-12018015-B2 Methods and compositions for targeting PD-L1 CD274, PDCD1LG2, PDCD1 PLG 3569/4885LMNA 2102/4885KCNA5 4635/4885
US-20110059963-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 PLG 2560/4885LMNA 2202/4885KCNA5 4086/4885
US-20130261117-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 PLG 2560/4885LMNA 2202/4885KCNA5 4086/4885
US-20160176865-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 PLG 2560/4885LMNA 2202/4885KCNA5 4086/4885
US-20230031213-A1 METHODS AND COMPOSITIONS FOR TARGETING PD-L1 CD274, PDCD1LG2, PDCD1 PLG 3569/4885LMNA 2102/4885KCNA5 4635/4885
US-20230137567-A1 IMMUNOMODULATING TRIFLUOROMETHYL-AMINAL AZALIDES ARG1, IL2, MALT1 PLG 4868/4885LMNA 4792/4885KCNA5 1821/4885
US-20170283424-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK1, JAK2, JAK3 PLG 3301/4885LMNA 4756/4885KCNA5 4413/4885

“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.