SCHEMBL2931900

SCHEMBL2931900

CS(=O)(=O)OCCn1cc2c(-c3ccccc3)c(-c3ccncc3)c(-c3ccccc3)nc2n1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 4/20 0.34
ADORA2A P29274 4/20 0.34
ADORA1 P30542 3/20 0.34
PDE10A Q9Y233 7/20 0.34
PDE4A P27815 5/20 0.34
PDE4B Q07343 5/20 0.34
PDE3B Q13370 4/20 0.34
PDE3A Q14432 4/20 0.34
CDC7 O00311 1/20 0.33
DBF4 Q9UBU7 1/20 0.33
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NSD3 Q9BZ95 1/20 0.32

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
SCHEMBL2932180 0.90 MAPK14 (0.40) ADORA3ADORA2AADORA1
SCHEMBL2932265 0.84 MAPK14 (0.39) ADORA3ADORA2AADORA1
SCHEMBL29652641 0.82 ADORA2A (0.39) ADORA3ADORA2AADORA1PDE10APDE4A
SCHEMBL1384405 0.80 CSNK1D (0.40) ADORA3ADORA2AADORA1PDE10APDE4A
SCHEMBL1385243 0.80 ADORA2A (0.42) ADORA3ADORA2AADORA1PDE10APDE4A
SCHEMBL1384574 0.80 MAPK14 (0.39) ADORA3ADORA2AADORA1MAPK1NPSR1
SCHEMBL14519364 0.79 PTGIR (0.48) PDE10APDE4APDE4BPDE3BPDE3A
SCHEMBL1387083 0.78 MAP4K4 (0.46) ADORA3ADORA2AADORA1PDE10APDE4A
SCHEMBL1385255 0.78 ALDH1A1 (0.37) ADORA3ADORA2AADORA1PDE10AMAPK1
SCHEMBL2926579 0.78 ADORA3 (0.39) ADORA3ADORA2AADORA1NPSR1

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 8 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 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
EP-1611131-A1 PYRAZOLOPYRIDINE DERIVATES J. Uriach y Compagnia S.A. (ES) 2006-01-04 EP disclosed
WO-2004076450-A1 PYRAZOLOPYRIDINE DERIVATES J. Uriach Y Compañia S.A. (ES) 2004-09-10 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 (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 3983/4885ADORA2A 3463/4885ADORA1 4004/4885
US-20090286983-A1 Pyrazolopyridine Derivates MAPK1, MAPK4, MAP4K2 ADORA3 4277/4885ADORA2A 3970/4885ADORA1 4368/4885
US-20090005377-A1 Pyrazolopyridine Derivates MAPK1, MAPK4, MAP4K2 ADORA3 4277/4885ADORA2A 3970/4885ADORA1 4368/4885

“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.