SCHEMBL13356095

SCHEMBL13356095

O=Cc1cn(CCO)c2ccc(Cc3cccc(Cl)c3Cl)cc2c1=O

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SLC22A12 Q96S37 2/20 0.36
▸ ALDH1A1 P00352 7/20 0.35
▸ SMN1; SMN2 Q16637 7/20 0.35
▸ HTT P42858 5/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ LMNA P02545 3/20 0.35
▸ CNR2 P34972 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ CMA1 P23946 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.32
▸ CFD P00746 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32

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
SCHEMBL1044635 0.84 GAA (0.45) SLC22A12ALDH1A1HTTLMNACNR2
SCHEMBL13862196 0.83 ALDH1A1 (0.36) SLC22A12ALDH1A1SMN1; SMN2HTTKMT2A
SCHEMBL3239637 0.81 SLC22A12 (0.39) SLC22A12ALDH1A1HTTLMNACNR2
SCHEMBL1043280 0.81 CNR2 (0.42) SLC22A12ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL3246672 0.79 CNR2 (0.38) SLC22A12ALDH1A1SMN1; SMN2LMNACNR2
SCHEMBL1045768 0.78 GAA (0.44) SLC22A12ALDH1A1HTTLMNACNR2
SCHEMBL1041186 0.78 GAA (0.45) SLC22A12ALDH1A1HTTLMNACNR2
SCHEMBL1046376 0.77 CNR2 (0.44) SLC22A12ALDH1A1HTTLMNACNR2
SCHEMBL1044727 0.77 CNR2 (0.44) HTTLMNACNR2CMA1
SCHEMBL13862215 0.76 ALDH1A1 (0.43) SLC22A12ALDH1A1SMN1; SMN2HTTKMT2A

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
EP-1564210-B9 4-OXOQUINOLINE COMPOUNDS AND UTILIZATION THEREOF AS HIV INTEGRASE INHIBITORS JAPAN TOBACCO INC (JP) 2010-03-31 — — EP disclosed
EP-1564210-B1 4-OXOQUINOLINE COMPOUNDS AND UTILIZATION THEREOF AS HIV INTEGRASE INHIBITORS JAPAN TOBACCO INC (JP) 2009-09-16 — — EP disclosed
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