SCHEMBL6822254

SCHEMBL6822254

CC(=O)Nc1cccc2c(-c3ccc(=O)n(C(C)C)n3)c(-c3ccccc3)nn12

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.42
ADORA1 P30542 1/20 0.39
POLB P06746 1/20 0.38
MAPT P10636 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
LDHA P00338 1/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
MAPK1 P28482 1/20 0.36
LMNA P02545 2/20 0.35
FYN P06241 2/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
NR4A2 P43354 1/20 0.34

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
SCHEMBL6821479 0.81 ADORA1 (0.38) TP53ADORA1POLBKMT2AMEN1
SCHEMBL6818850 0.79 PDE4B (0.42) TP53ADORA1SMN1; SMN2KMT2A
SCHEMBL6818870 0.78 ADORA1 (0.43) TP53ADORA1POLBMAPTSMN1; SMN2
SCHEMBL7039587 0.75 ADORA1 (0.57) ADORA1MAPK1
SCHEMBL6821474 0.74 ADORA1 (0.39) TP53ADORA1SMN1; SMN2KMT2AMEN1
SCHEMBL6822360 0.73 ADORA1 (0.44) TP53ADORA1POLBMAPTMAPK1
SCHEMBL6818390 0.73 ADORA1 (0.44) TP53ADORA1POLBMAPTMAPK1
SCHEMBL6539021 0.73 TP53 (0.45) TP53ADORA1POLBSMN1; SMN2LMNA
SCHEMBL6822354 0.73 ADORA1 (0.43) TP53ADORA1POLBMAPTSMN1; SMN2
SCHEMBL6133654 0.72 ALDH1A1 (0.54) TP53ADORA1MAPTKMT2AMEN1

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 TP53 4085/4885ADORA1 22/4885POLB 2828/4885

“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.