SCHEMBL5145706

SCHEMBL5145706

CC(C)(C)NC(=O)c1cccc(-c2n[nH]c3ccc(-c4nc[nH]n4)cc23)c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.52
DYRK1A Q13627 1/20 0.50
TTK P33981 2/20 0.48
MAPK8 P45983 2/20 0.48
MAP2K4 P45985 2/20 0.47
CSNK1D P48730 2/20 0.46
MAP3K5 Q99683 5/20 0.45
MAPK1 P28482 1/20 0.44
MAPKAPK3 Q16644 1/20 0.44
MAPK6 Q16659 1/20 0.44
LRRK2 Q5S007 2/20 0.43
PIM1 P11309 1/20 0.41
SYK P43405 1/20 0.41
ROCK2 O75116 2/20 0.41
ROCK1 Q13464 2/20 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
SCHEMBL5378125 0.89 CSNK1D (0.56) TTKMAPK8MAP2K4CSNK1DMAP3K5
SCHEMBL8258720 0.87 LRRK2 (0.52) DYRK1ATTKMAPK8MAP2K4CSNK1D
SCHEMBL17801052 0.86 TTK (0.53) TTKMAPK8MAP2K4CSNK1DMAP3K5
SCHEMBL5375633 0.84 MAP3K5 (0.54) TTKMAPK8MAP2K4CSNK1DMAP3K5
SCHEMBL5372266 0.84 MAP2K4 (0.63) TTKMAPK8MAP2K4CSNK1DMAP3K5
SCHEMBL8254966 0.84 AURKA (0.56) JAK2DYRK1ATTKMAPK8MAP2K4
SCHEMBL8257261 0.83 MAP3K5 (0.65) TTKMAPK8MAP2K4CSNK1DMAP3K5
SCHEMBL5380225 0.83 CSNK1D (0.56) DYRK1ATTKMAPK8MAP2K4CSNK1D
SCHEMBL8252590 0.83 CSNK1D (0.54) DYRK1ATTKMAPK8MAP2K4CSNK1D
SCHEMBL8257307 0.83 MAP3K5 (0.61) DYRK1AMAPK8MAP2K4MAP3K5MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170327788-A1 COMPOSITION FOR COLLECTING AND PRESERVING PLACENTAL STEM CELLS AND METHODS OF USING THE COMPOSITION ANTHROGENESIS CORPORATION (US) 2017-11-16 US disclosed
US-9725694-B2 Composition for collecting and preserving placental stem cells and methods of using the composition ANTHROGENESIS CORPORATION (US) 2017-08-08 US disclosed
US-9725694-B2 Composition for collecting and preserving placental stem cells and methods of using the composition ANTHROGENESIS CORPORATION (US) 2017-08-08 US disclosed
US-20100291679-A1 COMPOSITION FOR COLLECTING AND PRESERVING PLACENTAL STEM CELLS AND METHODS OF USING THE COMPOSITION ANTHROGENESIS CORPORATION 2010-11-18 US disclosed
US-20100291679-A1 COMPOSITION FOR COLLECTING AND PRESERVING PLACENTAL STEM CELLS AND METHODS OF USING THE COMPOSITION ANTHROGENESIS CORPORATION 2010-11-18 US disclosed
WO-2008091925-A2 TREATMENT OF AORTIC DISSECTION OR ANEURYSM COOK INCORPORATED (US) 2008-07-31 WO disclosed
WO-2008091925-A2 TREATMENT OF AORTIC DISSECTION OR ANEURYSM COOK INCORPORATED (US) 2008-07-31 WO disclosed
US-20070270448-A1 Methods of Using and Compositions Comprising a Jnk Inhibitor for the Treatment and Management of Asbestos-Related Diseases and Disorders CELGENE CORPORATION (US) 2007-11-22 US disclosed
US-20070270448-A1 Methods of Using and Compositions Comprising a Jnk Inhibitor for the Treatment and Management of Asbestos-Related Diseases and Disorders CELGENE CORPORATION (US) 2007-11-22 US disclosed
EP-1827422-A2 JNK INHIBITORS FOR THE TREATMENT OF CNS INJURY CELGENE CORPORATION (US) 2007-09-05 EP disclosed
WO-2006058007-A2 JNK INHIBITORS FOR TREATMENT OF CNS INJURY CELGENE CORPORATION (US) 2006-06-01 WO disclosed
WO-2006058007-A2 JNK INHIBITORS FOR TREATMENT OF CNS INJURY CELGENE CORPORATION (US) 2006-06-01 WO disclosed
CN-1668299-A Methods for using JNK inhibitors for treating or preventing disease-related wasting SIGNAL PHARM INC (US) 2005-09-14 CN disclosed
EP-1525308-A2 METHODS OF USING JNK OR MKK INHIBITORS TO MODULATE CELL DIFFERENTIATION AND TO TREAT MYELOPROLIFERATIVE DISORDERS AND MYELODYSPLASTIC SYNDROMES CELGENE CORPORATION (US) 2005-04-27 EP disclosed
WO-2004041191-A2 METHODS FOR THE TREATMENT, PREVENTION AND MANAGEMENT OF MACULAR DEGENERATION CELGENE CORPORATION (US) 2004-05-21 WO disclosed
US-20040087642-A1 Methods of using and compositions comprising a JNK inhibitor for the treatment, prevention, management and/or modification of pain CELGENE CORPORATION 2004-05-06 US disclosed
US-20040087642-A1 Methods of using and compositions comprising a JNK inhibitor for the treatment, prevention, management and/or modification of pain CELGENE CORPORATION 2004-05-06 US disclosed
WO-2003102151-A2 MODULATING CELL DIFFERENTIATION AND TREATING MYELOPROLIFERTIVE DISORDERS WITH JNK/MKK INHIBITORS CELGENE CORPORATION (US) 2003-12-11 WO disclosed
WO-2003102151-A2 MODULATING CELL DIFFERENTIATION AND TREATING MYELOPROLIFERTIVE DISORDERS WITH JNK/MKK INHIBITORS CELGENE CORPORATION (US) 2003-12-11 WO disclosed
WO-2003099221-A2 METHODS FOR USING JNK INHIBITORS FOR TREATING OR PREVENTING DISEASE-RELATED WASTING SIGNAL PHARMACEUTICALS, INC. (US) 2003-12-04 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 (2 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-20040087642-A1 Methods of using and compositions comprising a JNK inhibitor for the treatment, prevention, management and/or modification of pain MAP3K1, MAP3K6, MAPKAPK2 JAK2 236/4885DYRK1A 769/4885TTK 184/4885
US-20070270448-A1 Methods of Using and Compositions Comprising a Jnk Inhibitor for the Treatment and Management of Asbestos-Related Diseases and Disorders MAP3K6, MAP3K1, MAPK1 JAK2 406/4885DYRK1A 404/4885TTK 150/4885

“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.