SCHEMBL6822006

SCHEMBL6822006

COc1ccn2nc(-c3ccccc3)c(-c3ccc(=O)n(C)n3)c2c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.46
MAPK1 P28482 1/20 0.41
IGF1R P08069 1/20 0.39
BRD4 O60885 3/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
PTGER1 P34995 1/20 0.37
EGFR P00533 1/20 0.36
PHGDH O43175 1/20 0.36
CASR P41180 1/20 0.36
PTGDR2 Q9Y5Y4 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
SCHEMBL6822166 0.89 MAPK14 (0.44) ADORA1LMNAEGFR
SCHEMBL6822151 0.86 ADORA1 (0.54) ADORA1IGF1RPTGDR2
SCHEMBL6821431 0.86 ADORA1 (0.51) ADORA1MAPK1IGF1RPTGDR2
SCHEMBL6821959 0.86 ADORA1 (0.42) ADORA1MAPK1IGF1RPTGER1EGFR
SCHEMBL6824871 0.85 NPC1 (0.38) ADORA1BRD4PTGDR2
SCHEMBL8193833 0.83 ADORA1 (0.52) ADORA1MAPK1IGF1REGFR
SCHEMBL6822534 0.82 FGFR1 (0.40) ADORA1MAPK1IGF1R
SCHEMBL8809138 0.82 ADORA1 (0.64) ADORA1MAPK1IGF1RBRD4EGFR
SCHEMBL6822329 0.82 ADORA1 (0.41) ADORA1MAPK1IGF1RTP53PTGER1
SCHEMBL6822330 0.82 ADORA1 (0.41) ADORA1MAPK1IGF1RLMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040110763-A1 Pyrazolopyridine compound and pharmaceutical use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-10 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 (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-20040110763-A1 Pyrazolopyridine compound and pharmaceutical use thereof ADRB1, ADRA1D, ADRB3 ADORA1 22/4885MAPK1 1491/4885IGF1R 4150/4885

“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.