SCHEMBL3141848

SCHEMBL3141848

Cc1ccc(C(=O)NC2CC2)cc1-n1cnc2c(-c3ccccc3Cl)ncnc21

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 2/20 0.50
MAPK14 Q16539 17/20 0.48
MAPK11 Q15759 2/20 0.48
MAPK12 P53778 1/20 0.46
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
TP53 P04637 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL3145569 0.92 MAPK14 (0.50) MAPK14
SCHEMBL3148991 0.90 MAPK14 (0.49) MAPK14
SCHEMBL3149111 0.89 MAPK14 (0.52) MAPK13MAPK14
SCHEMBL3138765 0.89 MAPK14 (0.49) MAPK14
SCHEMBL3148553 0.88 MAPK14 (0.54) MAPK14
SCHEMBL3144145 0.88 MAPK14 (0.53) MAPK14MAPK11TP53MAPT
SCHEMBL14501551 0.87 MAPK14 (0.46) MAPK14TP53
SCHEMBL3150192 0.87 MAPK14 (0.46) MAPK13MAPK14MAPK11MAPK12
SCHEMBL3140544 0.87 MAPK14 (0.46) MAPK14
SCHEMBL3144069 0.86 MAPK14 (0.54) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1699800-B1 BICYCLIC HETEROCYCLIC P-38 KINASE INHIBITORS NOVARTIS AG (CH) 2010-02-10 EP claimed
US-10441577-B2 Medicament for treatment of liver cancer HELMHOLTZ ZENTRUM FUER INFEKTIONSFORSCHUNG (DE) 2019-10-15 US disclosed
US-20150079154-A1 MEDICAMENT FOR TREATMENT OF LIVER CANCER HELMHOLTZ-ZENTRUM FUER INFEKTIONSFORSCHUNG GMBH (DE) 2015-03-19 US disclosed
US-20150079154-A1 MEDICAMENT FOR TREATMENT OF LIVER CANCER HELMHOLTZ-ZENTRUM FUER INFEKTIONSFORSCHUNG GMBH (DE) 2015-03-19 US disclosed
EP-1699800-B1 BICYCLIC HETEROCYCLIC P-38 KINASE INHIBITORS NOVARTIS AG (CH) 2010-02-10 EP disclosed
US-20090264409-A1 Bicyclic Heterocyclic p-38 Kinase Inhibitors DONG QING 2009-10-22 US disclosed
US-20090264409-A1 Bicyclic Heterocyclic p-38 Kinase Inhibitors DONG QING 2009-10-22 US disclosed
US-20090264409-A1 Bicyclic Heterocyclic p-38 Kinase Inhibitors DONG QING 2009-10-22 US disclosed
US-7569571-B2 Substituted pyrazolo [3,4-d]pyrimidines as cytokine modulators NOVARTIS AG (CH) 2009-08-04 US disclosed
US-7569571-B2 Substituted pyrazolo [3,4-d]pyrimidines as cytokine modulators NOVARTIS AG (CH) 2009-08-04 US disclosed
US-7569571-B2 Substituted pyrazolo [3,4-d]pyrimidines as cytokine modulators NOVARTIS AG (CH) 2009-08-04 US disclosed
US-20070142405-A1 Such as N-cyclopropyl-4-methyl-3-(4-phenyl-pyrazolo[3,4-d]pyrimidin-1-yl)-benzamide; for inhibiting p38 kinase mediated diseases and disorders such as inflammatory diseases TRIAD THERAPEUTICS, INC. 2007-06-21 US disclosed
US-20070142405-A1 Such as N-cyclopropyl-4-methyl-3-(4-phenyl-pyrazolo[3,4-d]pyrimidin-1-yl)-benzamide; for inhibiting p38 kinase mediated diseases and disorders such as inflammatory diseases TRIAD THERAPEUTICS, INC. 2007-06-21 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-20090264409-A1 Bicyclic Heterocyclic p-38 Kinase Inhibitors MAPK8, MAP3K8, MAPKAPK2 MAPK13 29/4885MAPK14 35/4885MAPK11 43/4885
US-20070142405-A1 Such as N-cyclopropyl-4-methyl-3-(4-phenyl-pyrazolo[3,4-d]pyrimidin-1-yl)-benzamide; for inhibiting p38 kinase mediated diseases and disorders such as inflammatory diseases MAPK1, MAP3K8, MAP3K1 MAPK13 36/4885MAPK14 33/4885MAPK11 39/4885
US-10441577-B2 Medicament for treatment of liver cancer PYGL, PFKL, GLS2 MAPK13 685/4885MAPK14 523/4885MAPK11 684/4885
US-20150079154-A1 MEDICAMENT FOR TREATMENT OF LIVER CANCER PYGL, PFKL, GLS2 MAPK13 685/4885MAPK14 523/4885MAPK11 684/4885

“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.