SCHEMBL1386149

SCHEMBL1386149

CSc1nccc(-c2cc3cn(CCCOC4CCCCO4)nc3nc2-c2cccc(C(F)(F)F)c2)n1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 2/20 0.37
TGFBR2 P37173 1/20 0.37
MET P08581 2/20 0.35
MAPK14 Q16539 10/20 0.33
MAPK13 O15264 6/20 0.33
MAPK12 P53778 6/20 0.33
MAPK11 Q15759 6/20 0.33
MAPK9 P45984 1/20 0.33
LMNA P02545 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
ATR Q13535 1/20 0.31
KDM4C Q9H3R0 1/20 0.31

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
SCHEMBL1386172 0.88 MAPK14 (0.40) TGFBR1TGFBR2METMAPK14MAPK13
SCHEMBL1384645 0.84 MET (0.40) TGFBR1TGFBR2METMAPK14MAPK13
SCHEMBL1386381 0.82 MAPK14 (0.43) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL29652684 0.81 LMNA (0.37) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL1384356 0.75 MAPK14 (0.39) TGFBR1TGFBR2METMAPK14MAPK13
SCHEMBL1385020 0.69 KMO (0.36) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL1385005 0.68 MAPK14 (0.44) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL1384875 0.67 MAPK14 (0.45) TGFBR1MAPK14MAPK13MAPK12MAPK11
SCHEMBL29652669 0.67 MAPK14 (0.42) TGFBR1TGFBR2MAPK14MAPK13MAPK12
SCHEMBL29893768 0.67 MAPK14 (0.45) MAPK14MAPK13MAPK12MAPK11MAPK9

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-8536194-B2 Pyrazolopyridine derivates PALAU PHARMA, S.A. (ES) 2013-09-17 US claimed
JP-4814783-B2 2011-11-16 JP claimed
EP-1611131-B1 PYRAZOLOPYRIDINE DERIVATES PALAU PHARMA SA (ES) 2010-09-15 EP claimed
US-20090005377-A1 Pyrazolopyridine Derivates PALAU PHARMA, S.A. (ES) 2009-01-01 US claimed
US-7468376-B2 Pyrazolopyridine derivates PALAU PHARMA, S.A. (ES) 2008-12-23 US claimed
US-20060167040-A1 Pyrazolopyridine derivates J. URIACH Y COMPANIA S.A. (ES) 2006-07-27 US claimed
EP-1611131-A1 PYRAZOLOPYRIDINE DERIVATES J. Uriach y Compagnia S.A. (ES) 2006-01-04 EP claimed
WO-2004076450-A1 PYRAZOLOPYRIDINE DERIVATES J. Uriach Y Compañia S.A. (ES) 2004-09-10 WO claimed
US-8536194-B2 Pyrazolopyridine derivates PALAU PHARMA, S.A. (ES) 2013-09-17 US disclosed
EP-1611131-B1 PYRAZOLOPYRIDINE DERIVATES PALAU PHARMA SA (ES) 2010-09-15 EP disclosed
US-20090286983-A1 Pyrazolopyridine Derivates PALAU PHARMA, S.A. (ES) 2009-11-19 US disclosed
US-20090005377-A1 Pyrazolopyridine Derivates PALAU PHARMA, S.A. (ES) 2009-01-01 US disclosed
US-7468376-B2 Pyrazolopyridine derivates PALAU PHARMA, S.A. (ES) 2008-12-23 US disclosed
US-20060167040-A1 Pyrazolopyridine derivates J. URIACH Y COMPANIA S.A. (ES) 2006-07-27 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 (3 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-20060167040-A1 Pyrazolopyridine derivates MAPK1, MAP4K2, MAP4K3 TGFBR1 3194/4885TGFBR2 4047/4885MET 3271/4885
US-20090286983-A1 Pyrazolopyridine Derivates MAPK1, MAPK4, MAP4K2 TGFBR1 2719/4885TGFBR2 3357/4885MET 3684/4885
US-20090005377-A1 Pyrazolopyridine Derivates MAPK1, MAPK4, MAP4K2 TGFBR1 2719/4885TGFBR2 3357/4885MET 3684/4885

“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.