SCHEMBL6818407

SCHEMBL6818407

CCn1nc(-c2c(-c3ccccc3)nn3c(OC)cccc23)ccc1=O

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 1/20 0.45
PDE4B Q07343 5/20 0.45
PDE5A O76074 1/20 0.45
PDE3A Q14432 1/20 0.45
HTT P42858 1/20 0.41
MAPK14 Q16539 1/20 0.39
PDE4A P27815 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
CHEK1 O14757 1/20 0.36
NEK2 P51955 1/20 0.36
LIMK1 P53667 1/20 0.36
TYRO3 Q06418 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL6822088 0.92 ADORA1 (0.48) ADORA1PDE4BPDE5APDE3AHTT
SCHEMBL6822070 0.85 ADORA1 (0.41) ADORA1PDE4BPDE5APDE3AMAPK14
SCHEMBL6818850 0.83 PDE4B (0.42) ADORA1PDE4BPDE5APDE3AMAPK14
SCHEMBL6822604 0.78 PDE4B (0.51) PDE4BPDE5APDE3AMAPK14PDE4A
SCHEMBL6821431 0.77 ADORA1 (0.51) ADORA1PDE4BPDE5APDE3AHTT
SCHEMBL7364039 0.73 ADORA1 (0.54) ADORA1PDE4BHTTPDE4APDE4C
SCHEMBL4054492 0.72 HTT (0.62) HTTMEN1KMT2ASMN1; SMN2
SCHEMBL6821400 0.72 AURKA (0.36) PDE4BHTTMAPK14
Bromide SCHEMBL5751833 0.71 HTT (0.61) HTTMEN1KMT2ASMN1; SMN2
SCHEMBL27659527 0.70 HTT (0.47) ADORA1PDE4BHTTPDE4APDE4C

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 22/4885PDE4B 563/4885PDE5A 187/4885

“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.