SCHEMBL6552154

SCHEMBL6552154

CCOC(=O)Oc1[nH]c(C)nc1SCC

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.35
MAPT P10636 2/20 0.35
SOAT1 P35610 1/20 0.33
PPARG P37231 1/20 0.32
NCOA2 Q15596 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
POLB P06746 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDM4E B2RXH2 3/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
RECQL P46063 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL6551633 0.83 ALOX5 (0.35) ALDH1A1MAPTSOAT1SMN1; SMN2
SCHEMBL10438826 0.65 ALDH1A1 (0.40) ALDH1A1MAPTSOAT1SMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL8709929 0.63 ALDH1A1 (0.33) ALDH1A1MAPTSMN1; SMN2GAA
SCHEMBL9236366 0.62 ALDH1A1 (0.41) ALDH1A1MAPTSOAT1POLBSMN1; SMN2
SCHEMBL7211988 0.62 ALDH1A1 (0.54) ALDH1A1MAPTSOAT1POLBSMN1; SMN2
SCHEMBL7756478 0.61 ALDH1A1 (0.37) ALDH1A1MAPTSOAT1SMN1; SMN2KDM4E
SCHEMBL9080422 0.61 KDM4E (0.44) ALDH1A1SOAT1SMN1; SMN2KDM4EHPGD
SCHEMBL5243244 0.61 KDM4E (0.44) ALDH1A1SOAT1SMN1; SMN2KDM4EHPGD
SCHEMBL10004063 0.61 ALDH1A1 (0.48) ALDH1A1RXFP1SMN1; SMN2KDM4EHPGD
SCHEMBL7013807 0.60 ALDH1A1 (0.48) ALDH1A1MAPTSOAT1KDM4EHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1051402-B1 METHOD FOR PRODUCING S-ALKYL(ARYL)-SUBSTITUTED IMIDAZOLE DERIVATIVES AVENTIS PHARMA GMBH (DE) 2004-12-08 EP disclosed
EP-1051402-A1 METHOD FOR PRODUCING S-ALKYL(ARYL)-SUBSTITUTED IMIDAZOL DERIVATIVES Aventis Pharma Deutschland GmbH (DE) 2000-11-15 EP disclosed
WO-1999037620-A1 METHOD FOR PRODUCING S-ALKYL(ARYL)-SUBSTITUTED IMIDAZOL DERIVATIVES AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-07-29 WO disclosed