SCHEMBL11443590

SCHEMBL11443590

CCCc1c(OCc2ccccc2)ccc2c(=O)o[c]cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.39
▸ MAPT P10636 4/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ POLB P06746 1/20 0.38
▸ PDE5A O76074 1/20 0.38
▸ MAOB P27338 5/20 0.38
▸ FFAR4 Q5NUL3 1/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ HPGD P15428 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ MAPK1 P28482 3/20 0.35
▸ NTSR1 P30989 2/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ GAA P10253 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
SCHEMBL9118750 0.72 MAOB (0.47) MAPK14PDE5AMAOBGAA
SCHEMBL6559983 0.70 MAOB (0.43) MAPTKDM4EALDH1A1POLBPDE5A
SCHEMBL6559981 0.69 PDE5A (0.48) MAPTKDM4EALDH1A1POLBPDE5A
SCHEMBL27656755 0.69 KDM4E (0.46) MAPK14MAPTKDM4EALDH1A1L3MBTL1
SCHEMBL6561528 0.68 KDM4E (0.49) MAPTKDM4EALDH1A1POLBPDE5A
SCHEMBL10972035 0.68 PDE5A (0.52) MAPTKDM4EALDH1A1POLBPDE5A
SCHEMBL7041646 0.68 PPARA (0.53) —
SCHEMBL10975462 0.67 PDE5A (0.51) MAPTKDM4EALDH1A1POLBPDE5A
SCHEMBL7038827 0.67 PPARA (0.46) —
SCHEMBL8474968 0.66 HTR1A (0.46) MAPTL3MBTL1SMN1; SMN2NPC1RAB9A

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
EP-0017332-A1 Pharmaceutical heterocyclic compounds, processes for their preparation and compositions containing them FISONS plc (GB) 1980-10-15 — — EP disclosed
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