SCHEMBL12692147

SCHEMBL12692147

N#Cc1c(-c2ccc(O)cc2)nc2[nH]nc(-c3ccccc3)c2c1-c1ccc(O)cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 12/20 0.55
ADORA1 P30542 6/20 0.54
ADORA2A P29274 4/20 0.54
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CDK5 Q00535 1/20 0.43
DYRK1A Q13627 1/20 0.43
CDK5R1 Q15078 1/20 0.43
ADORA2B P29275 1/20 0.42

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
SCHEMBL16790912 0.94 GRM5 (0.55) GRM5ADORA1ADORA2AMEN1KMT2A
SCHEMBL12691967 0.91 ADORA1 (0.53) GRM5ADORA1ADORA2AADORA2B
SCHEMBL12694457 0.88 GRM5 (0.67) GRM5ADORA1ADORA2AMEN1KMT2A
SCHEMBL12691985 0.84 ADORA1 (0.49) GRM5ADORA1ADORA2AMEN1KMT2A
SCHEMBL12692087 0.84 GRM5 (0.49) GRM5ADORA1ADORA2AADORA2B
SCHEMBL12694617 0.82 GRM5 (0.61) GRM5ADORA1ADORA2AADORA2B
SCHEMBL12692066 0.79 ADORA1 (0.53) GRM5ADORA1ADORA2AMEN1KMT2A
SCHEMBL12691994 0.79 ADORA1 (0.53) GRM5ADORA1ADORA2AMEN1KMT2A
SCHEMBL12692153 0.77 ADORA1 (0.46) GRM5ADORA1ADORA2AMEN1KMT2A
SCHEMBL12692085 0.77 GRM5 (0.51) GRM5ADORA1ADORA2AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488519-B1 PYRAZOLOPYRIDINE DERIVATIVES AS ANTICANCER AGENT PF MEDICAMENT (FR) 2015-06-10 EP disclosed
US-8889711-B2 Pyrazolopyridine derivatives as anticancer agent PIERRE FABRE MEDICAMENT (FR) 2014-11-18 US disclosed
US-8889711-B2 Pyrazolopyridine derivatives as anticancer agent PIERRE FABRE MEDICAMENT (FR) 2014-11-18 US disclosed
US-20120245170-A1 PYRAZOLOPYRIDINE DERIVATIVES AS ANTICANCER AGENT PIERRE FABRE MEDICAMENT (FR) 2012-09-27 US disclosed
US-20120245170-A1 PYRAZOLOPYRIDINE DERIVATIVES AS ANTICANCER AGENT PIERRE FABRE MEDICAMENT (FR) 2012-09-27 US disclosed
WO-2011045344-A1 PYRAZOLOPYRIDINE DERIVATIVES AS ANTICANCER AGENT PIERRE FABRE MEDICAMENT (FR) 2011-04-21 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 (1 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-20120245170-A1 PYRAZOLOPYRIDINE DERIVATIVES AS ANTICANCER AGENT DPYD, TYMP, ABCB1 GRM5 3618/4885ADORA1 3012/4885ADORA2A 2774/4885

“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.