SCHEMBL6822341

SCHEMBL6822341

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

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.42
FYN P06241 3/20 0.41
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ACSS2 Q9NR19 2/20 0.38
PDCD1 Q15116 1/20 0.37
CD274 Q9NZQ7 1/20 0.37
BRD4 O60885 1/20 0.36
TP53 P04637 1/20 0.36
GCGR P47871 2/20 0.36
CGAS Q8N884 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 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
SCHEMBL6821913 0.91 ADORA1 (0.43) ADORA1KDM4EALDH1A1GAAHPGD
SCHEMBL6821972 0.91 CAMK2D (0.44) ADORA1FYNACSS2HPGD
SCHEMBL6822459 0.91 ADORA1 (0.41) ADORA1L3MBTL1TP53GCGRKDM4E
SCHEMBL6821521 0.89 MAPK1 (0.41) ADORA1BRD4TP53ALDH1A1HPGD
SCHEMBL6822550 0.89 ADORA1 (0.40) ADORA1L3MBTL1ACSS2TP53GCGR
SCHEMBL6822338 0.88 MEN1 (0.49) ADORA1GAA
SCHEMBL6822494 0.88 ADORA1 (0.43) ADORA1ACSS2TP53ALDH1A1
SCHEMBL6822105 0.87 ADORA1 (0.43) ADORA1ACSS2TP53KDM4EALDH1A1
SCHEMBL6818544 0.86 ADORA1 (0.46) ADORA1TP53HPGD
SCHEMBL6824733 0.86 ADORA1 (0.43) ADORA1

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 22/4885FYN 20/4885NPSR1 39/4885

“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.