SCHEMBL4760650

SCHEMBL4760650

CN(C)C(=O)C(=O)N1CCC(NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.50
HSD11B1 P28845 9/20 0.48
CYP2C9 P11712 1/20 0.48
EPHX1 P07099 1/20 0.48
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
NAMPT P43490 1/20 0.44
BTK Q06187 1/20 0.43
KCNA3 P22001 1/20 0.41
PARP1 P09874 2/20 0.41
CKS1B P61024 1/20 0.41
SKP1 P63208 1/20 0.41
SKP2 Q13309 1/20 0.41

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
SCHEMBL4760643 0.92 HSD11B1 (0.55) CTSKHSD11B1CYP2C9EPHX1CA1
SCHEMBL880503 0.85 CTSK (0.52) CTSKHSD11B1CYP2C9EPHX1CA1
SCHEMBL2692802 0.85 CTSK (0.55) CTSKHSD11B1CYP2C9EPHX1CA1
SCHEMBL27172341 0.84 CTSK (0.54) CTSKHSD11B1CYP2C9EPHX1CA1
SCHEMBL26255224 0.81 HSD11B1 (0.52) CTSKHSD11B1CYP2C9EPHX1CA1
SCHEMBL89460 0.80 EPHX2 (0.56) CTSKHSD11B1CYP2C9EPHX1CA1
SCHEMBL27408850 0.80 CTSK (0.56) CTSKHSD11B1CYP2C9EPHX1CA1
SCHEMBL18926997 0.80 EPHX1 (0.70) CTSKHSD11B1CYP2C9EPHX1CA1
SCHEMBL6187601 0.80 CTSK (0.56) CTSKHSD11B1CYP2C9EPHX1CA1
SCHEMBL4760808 0.80 CTSK (0.50) CTSKHSD11B1CYP2C9EPHX1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524709-B2 Kinase inhibitor compounds TYROGENEX, INC. (US) 2013-09-03 US disclosed
US-8524709-B2 Kinase inhibitor compounds TYROGENEX, INC. (US) 2013-09-03 US disclosed
US-20120115866-A1 KINASE INHIBITOR COMPOUNDS TYROGENEX, INC. (US) 2012-05-10 US disclosed
US-20120115866-A1 KINASE INHIBITOR COMPOUNDS TYROGENEX, INC. (US) 2012-05-10 US disclosed
US-8039470-B2 Kinase inhibitor compounds TYROGENEX, INC. (US) 2011-10-18 US disclosed
US-8039470-B2 Kinase inhibitor compounds TYROGENEX, INC. (US) 2011-10-18 US disclosed
US-20110224212-A1 KINASE INHIBITOR COMPOUNDS TYROGENEX, INC. (US) 2011-09-15 US disclosed
US-20110224212-A1 KINASE INHIBITOR COMPOUNDS TYROGENEX, INC. (US) 2011-09-15 US disclosed
US-20100261665-A1 Kinase inhibitor compounds XCOVERY, INC. (US) 2010-10-14 US disclosed
US-20100261665-A1 Kinase inhibitor compounds XCOVERY, INC. (US) 2010-10-14 US disclosed
US-7683057-B2 5-[5-fluoro-2-oxo-1,2-dihydro-indol-(3Z)-ylidenemethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (1-acetyl-piperidin-4-yl)-amide; inhibition of 5' AMP-activated protein kinase (AMPK) TYROGENEX, INC. (US) 2010-03-23 US disclosed
US-7683057-B2 5-[5-fluoro-2-oxo-1,2-dihydro-indol-(3Z)-ylidenemethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid (1-acetyl-piperidin-4-yl)-amide; inhibition of 5' AMP-activated protein kinase (AMPK) TYROGENEX, INC. (US) 2010-03-23 US disclosed
US-20090076005-A1 Kinase inhibitor compounds XCOVERY, INC. (US) 2009-03-19 US disclosed
US-20090076005-A1 Kinase inhibitor compounds XCOVERY, INC. (US) 2009-03-19 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 (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-20090076005-A1 Kinase inhibitor compounds MAP3K1, MAP3K20, MAP3K2 CTSK 571/4885HSD11B1 2215/4885CYP2C9 4586/4885
US-20120115866-A1 KINASE INHIBITOR COMPOUNDS MAP3K1, MAP3K20, MAP3K2 CTSK 571/4885HSD11B1 2215/4885CYP2C9 4586/4885
US-20100261665-A1 Kinase inhibitor compounds MAP3K1, MAP3K20, MAP3K2 CTSK 571/4885HSD11B1 2215/4885CYP2C9 4586/4885
US-20110224212-A1 KINASE INHIBITOR COMPOUNDS MAP3K1, MAP3K20, MAP3K2 CTSK 571/4885HSD11B1 2215/4885CYP2C9 4586/4885

“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.