SCHEMBL1386148

SCHEMBL1386148

OCCCn1cc2c(-c3ccco3)c(-c3ccncc3)c(-c3ccc(F)cc3)nc2n1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 12/20 0.49
ADORA1 P30542 9/20 0.49
ADORA2B P29275 7/20 0.42
ADORA2A P29274 7/20 0.42
MAPK14 Q16539 6/20 0.42
CSNK1D P48730 2/20 0.41
MAP4K4 O95819 1/20 0.41
MAPK9 P45984 1/20 0.41
CSNK1A1 P48729 1/20 0.41
CDC42BPA Q5VT25 1/20 0.41
AURKB Q96GD4 1/20 0.41
MAP4K5 Q9Y4K4 1/20 0.41
MAPK13 O15264 1/20 0.36
CSNK1E P49674 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
EGFR P00533 1/20 0.36
RAF1 P04049 1/20 0.36
GSK3B P49841 1/20 0.36

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
SCHEMBL2929628 0.88 MAPK14 (0.49) ADORA3ADORA1ADORA2BADORA2AMAPK14
SCHEMBL29652678 0.87 ADORA3 (0.45) ADORA3ADORA1ADORA2BADORA2AMAPK14
SCHEMBL1384559 0.85 MAPK14 (0.46) ADORA3ADORA1ADORA2BADORA2AMAPK14
SCHEMBL1384371 0.85 MAPK14 (0.43) ADORA3ADORA1MAPK14CSNK1DMAP4K4
SCHEMBL29332356 0.84 MAPK14 (0.48) MAPK14CSNK1DMAP4K4MAPK9CSNK1A1
SCHEMBL1386702 0.84 MAPK14 (0.46) ADORA3ADORA1ADORA2BADORA2AMAPK14
SCHEMBL1383998 0.82 MAPK14 (0.47) ADORA3ADORA1ADORA2BADORA2AMAPK14
SCHEMBL1386958 0.82 MAPK14 (0.42) ADORA3ADORA1ADORA2BADORA2AMAPK14
SCHEMBL2928707 0.81 ADORA3 (0.36) ADORA3ADORA1ADORA2BADORA2AMAPK14
SCHEMBL1387083 0.80 MAP4K4 (0.46) ADORA3ADORA1ADORA2AMAPK14CSNK1D

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 ADORA3 3983/4885ADORA1 4004/4885ADORA2B 4238/4885
US-20090286983-A1 Pyrazolopyridine Derivates MAPK1, MAPK4, MAP4K2 ADORA3 4277/4885ADORA1 4368/4885ADORA2B 4436/4885
US-20090005377-A1 Pyrazolopyridine Derivates MAPK1, MAPK4, MAP4K2 ADORA3 4277/4885ADORA1 4368/4885ADORA2B 4436/4885

“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.