SCHEMBL30951531

SCHEMBL30951531

COc1ccc2ncc3c(-c4ccc(OC)c(OC)c4)n[nH]c3c2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 2/20 0.47
▸ DYRK1B Q9Y463 1/20 0.47
▸ PDE4A P27815 2/20 0.47
▸ PDE4B Q07343 2/20 0.47
▸ PDE4C Q08493 2/20 0.47
▸ PDE4D Q08499 2/20 0.47
▸ MAPT P10636 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ ALOX12 P18054 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ GABRA1 P14867 1/20 0.45
▸ GABRG2 P18507 1/20 0.45
▸ GABRB3 P28472 1/20 0.45
▸ GABRA5 P31644 1/20 0.45
▸ GABRA3 P34903 1/20 0.45
▸ GABRA2 P47869 1/20 0.45
▸ PIK3CD O00329 1/20 0.44

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
SCHEMBL29254456 1.00 DYRK1A (0.47) DYRK1ADYRK1BPDE4APDE4BPDE4C
SCHEMBL30951527 0.85 PDE4A (0.59) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL29254459 0.85 PDE4A (0.59) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL29254435 0.77 GABRA1 (0.50) MAPTKDM4ELMNAMAPK1GABRA1
SCHEMBL30951512 0.77 PDE4A (0.54) DYRK1ADYRK1BPDE4APDE4BPDE4C
SCHEMBL29254461 0.77 PDE4A (0.54) DYRK1ADYRK1BPDE4APDE4BPDE4C
SCHEMBL4842001 0.74 PDE4A (0.73) DYRK1ADYRK1BPDE4APDE4BPDE4C
SCHEMBL29930898 0.70 DYRK1A (0.65) DYRK1ADYRK1BKIT
SCHEMBL30951522 0.69 MAPT (0.63) PDE4APDE4BPDE4CPDE4DMAPT
Hydrochloric Acid SCHEMBL30951578 0.68 MAPT (0.62) PDE4APDE4BPDE4CPDE4DMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118076605-A Substituted 1H-pyrazolo [4,3-c ] quinolines, methods of preparation and uses thereof 洛蒙治疗公司 2024-05-24 — — CN claimed
CN-118076605-A Substituted 1H-pyrazolo [4,3-c ] quinolines, methods of preparation and uses thereof 洛蒙治疗公司 2024-05-24 — — CN disclosed
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