SCHEMBL12883291

SCHEMBL12883291

CC(CC(N)=O)c1cccnc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.51
TBXAS1 P24557 3/20 0.46
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
KCNA5 P22460 6/20 0.44
F7 P08709 1/20 0.44
F3 P13726 1/20 0.44
SARM1 Q6SZW1 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
SIRT6 Q8N6T7 1/20 0.44
SIRT1 Q96EB6 1/20 0.44
SIRT3 Q9NTG7 1/20 0.44
SIRT5 Q9NXA8 1/20 0.44
SIRT4 Q9Y6E7 1/20 0.44
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
NAPRT Q6XQN6 1/20 0.42

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
SCHEMBL2370434 1.00 L3MBTL1 (0.51) L3MBTL1TBXAS1LMNASMN1; SMN2KCNA5
SCHEMBL1209573 0.85 L3MBTL1 (0.56) L3MBTL1TBXAS1LMNASMN1; SMN2KCNA5
SCHEMBL17591684 0.84 TBXAS1 (0.44) L3MBTL1TBXAS1LMNASMN1; SMN2KCNA5
SCHEMBL9467735 0.83 L3MBTL1 (0.51) L3MBTL1TBXAS1LMNASMN1; SMN2KCNA5
SCHEMBL17591689 0.83 LMNA (0.54) L3MBTL1TBXAS1LMNASMN1; SMN2KCNA5
SCHEMBL9519691 0.82 L3MBTL1 (0.50) L3MBTL1TBXAS1LMNASMN1; SMN2KCNA5
SCHEMBL15591082 0.81 LMNA (0.46) L3MBTL1TBXAS1LMNASMN1; SMN2KCNA5
SCHEMBL27956700 0.81 L3MBTL1 (0.49) L3MBTL1TBXAS1LMNASMN1; SMN2F7
SCHEMBL23685640 0.81 L3MBTL1 (0.59) L3MBTL1LMNASMN1; SMN2KCNA5MEN1
SCHEMBL16432496 0.81 SMN1; SMN2 (0.47) L3MBTL1TBXAS1LMNASMN1; SMN2F7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150272947-A1 INHIBITORS OF PROTEIN KINASES ASTRAZENECA AB (SE) 2015-10-01 US disclosed
US-9067888-B2 Inhibitors of protein kinases ASTRAZENECA AB (SE) 2015-06-30 US disclosed
CN-102834380-B Inhibitors of protein kinases ASTRAZENECA 2015-04-01 CN disclosed
US-20130345233-A1 INHIBITORS OF PROTEIN KINASES INGENIUM PHARMACEUTICALS GMBH (DE) 2013-12-26 US disclosed
US-8518948-B2 Inhibitors of protein kinases INGENIUM PHARMACEUTICALS GMBH (DE) 2013-08-27 US disclosed
EP-2545037-A1 INHIBITORS OF PROTEIN KINASES Ingenium Pharmaceuticals GmbH (DE) 2013-01-16 EP disclosed
US-20110224225-A1 Inhibitors of protein kinases ASTRAZENECA AB (SE) 2011-09-15 US disclosed
WO-2011110612-A1 INHIBITORS OF PROTEIN KINASES INGENIUM PHARMACEUTICALS GMBH (DE) 2011-09-15 WO disclosed
US-20110046128-A1 NOVEL COMPOUNDS ADVANTAGEOUS IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES AND DISORDERS AURIMMED PHARMA, INC. (US) 2011-02-24 US disclosed
US-20110046128-A1 NOVEL COMPOUNDS ADVANTAGEOUS IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES AND DISORDERS AURIMMED PHARMA, INC. (US) 2011-02-24 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-20130345233-A1 INHIBITORS OF PROTEIN KINASES CDK1, CDK2, CDK3 L3MBTL1 2099/4885TBXAS1 793/4885LMNA 1506/4885
US-20150272947-A1 INHIBITORS OF PROTEIN KINASES CDK1, CDK2, CDK3 L3MBTL1 2099/4885TBXAS1 793/4885LMNA 1506/4885
US-20110046128-A1 NOVEL COMPOUNDS ADVANTAGEOUS IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES AND DISORDERS GAP43, CHRNA10, CHRNA6 L3MBTL1 2159/4885TBXAS1 553/4885LMNA 2068/4885
US-20110224225-A1 Inhibitors of protein kinases CDK1, CDK2, CDK3 L3MBTL1 2099/4885TBXAS1 793/4885LMNA 1506/4885

“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.