SCHEMBL6818403

SCHEMBL6818403

CC(C)n1nc(-c2c(-c3ccccc3)nn3ccc(NC(=O)OC(C)(C)C)cc23)ccc1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.40
BRD9 Q9H8M2 1/20 0.39
ACSS2 Q9NR19 1/20 0.39
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.36
IGF1R P08069 1/20 0.34
BRD4 O60885 1/20 0.34
CYP17A1 P05093 1/20 0.34
PIK3CD O00329 1/20 0.34
ABL1 P00519 1/20 0.34
EGFR P00533 1/20 0.34
KDR P35968 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CG P48736 1/20 0.34
BACE1 P56817 1/20 0.34
PRKDC P78527 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
BCL2 P10415 1/20 0.34
BECN1 Q14457 1/20 0.34
MAPK8 P45983 2/20 0.33

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
SCHEMBL6822610 0.91 ADORA1 (0.42) ADORA1TP53POLBIGF1RMAPK8
SCHEMBL6822360 0.88 ADORA1 (0.44) ADORA1TP53POLBIGF1R
SCHEMBL6818390 0.88 ADORA1 (0.44) ADORA1TP53POLBIGF1R
SCHEMBL6818870 0.87 ADORA1 (0.43) ADORA1TP53POLBIGF1R
SCHEMBL6989388 0.87 ADORA1 (0.43) ADORA1TP53POLBIGF1R
SCHEMBL6822479 0.87 TP53 (0.45) ADORA1TP53POLBIGF1R
SCHEMBL6824283 0.86 ADORA1 (0.42) ADORA1TP53POLBMAPK8MAPK9
SCHEMBL6822191 0.81 ADORA1 (0.45) ADORA1TP53POLB
SCHEMBL6825096 0.80 ADORA1 (0.39) ADORA1TP53POLBIGF1RBRD4
SCHEMBL6822354 0.80 ADORA1 (0.43) ADORA1TP53POLBIGF1R

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 22/4885BRD9 1023/4885ACSS2 1145/4885

“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.