SCHEMBL7996864

SCHEMBL7996864

N#Cc1ccc(CCOc2ccc(/C=C3\SC(=O)NC3=O)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 12/20 0.74
▸ CISD1 Q9NZ45 1/20 0.63
▸ PIM1 P11309 2/20 0.62
▸ PIM2 Q9P1W9 2/20 0.62
▸ PTPN1 P18031 2/20 0.60
▸ MAOA P21397 2/20 0.57
▸ MAOB P27338 2/20 0.57
▸ PTGS2 P35354 1/20 0.57
▸ ESRRA P11474 1/20 0.57
▸ POLB P06746 1/20 0.56

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
SCHEMBL7996867 1.00 HPGD (0.74) HPGDCISD1PIM1PIM2PTPN1
SCHEMBL6381880 0.85 HPGD (0.77) HPGDCISD1PIM1PIM2PTPN1
SCHEMBL6381881 0.85 HPGD (0.77) HPGDCISD1PIM1PIM2PTPN1
SCHEMBL1300347 0.85 HPGD (1.00) HPGDCISD1PIM1PIM2PTPN1
SCHEMBL6866778 0.85 HPGD (1.00) HPGDCISD1PIM1PIM2PTPN1
SCHEMBL1300345 0.85 HPGD (1.00) HPGDCISD1PIM1PIM2PTPN1
SCHEMBL8003882 0.82 HPGD (0.72) HPGDCISD1PIM1PIM2PTPN1
SCHEMBL7996853 0.81 HPGD (0.71) HPGDCISD1PIM1PIM2PTPN1
SCHEMBL7996857 0.81 HPGD (0.71) HPGDCISD1PIM1PIM2PTPN1
SCHEMBL8003791 0.81 HPGD (0.71) HPGDCISD1PIM1PIM2PTPN1

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-6288096-B1 ANTIDIABETIC AGENTS, HYPOTENSIVE AGENTS, AND ANTICHOLESTEROL AGENTS ASTRAZENECA AB (SE) 2001-09-11 — — US disclosed
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