SCHEMBL6131910

SCHEMBL6131910

OCCONc1ccc(O)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.38
ALDH1A1 P00352 7/20 0.37
MAPT P10636 5/20 0.37
GAA P10253 5/20 0.37
KDM4E B2RXH2 4/20 0.37
L3MBTL1 Q9Y468 4/20 0.37
THRB P10828 3/20 0.37
KMT2A Q03164 5/20 0.35
MEN1 O00255 4/20 0.35
HPGD P15428 4/20 0.35
ALOX15 P16050 4/20 0.35
BLM P54132 4/20 0.35
HSD17B10 Q99714 4/20 0.35
CA1 P00915 3/20 0.35
CYP3A4 P08684 3/20 0.35
RECQL P46063 3/20 0.35
CA12 O43570 2/20 0.35
CA3 P07451 2/20 0.35
CA4 P22748 2/20 0.35
CA9 Q16790 2/20 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
SCHEMBL8942376 0.81 LTA4H (0.46) CA2ALDH1A1MAPTGAAKDM4E
SCHEMBL1401823 0.81 APP (0.46) ALDH1A1THRBHPGDALOX15HSD17B10
SCHEMBL33691 0.81 MAPT (0.39) ALDH1A1MAPTGAAKDM4EL3MBTL1
SCHEMBL28630486 0.81 MAPT (0.41) ALDH1A1MAPTGAAKDM4EL3MBTL1
SCHEMBL10697594 0.80 ALDH1A1 (0.46) ALDH1A1MAPTGAAL3MBTL1HPGD
SCHEMBL9173603 0.76 ADRB2 (0.38) CA2ALDH1A1MAPTGAAKDM4E
SCHEMBL11795587 0.76 ALDH1A1 (0.42) CA2ALDH1A1MAPTGAAKDM4E
SCHEMBL808654 0.75 NR5A1 (0.58) ALDH1A1KDM4EHSD17B10CYP3A4HIF1A
SCHEMBL27795100 0.75 NR5A1 (0.58) ALDH1A1KDM4EHSD17B10CYP3A4HIF1A
SCHEMBL27347527 0.72 TRPV1 (0.53) RECQLLMNANPC1RAB9AEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1032559-A4 AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS AVENTIS PHARMA INC (US) 2005-05-25 EP disclosed
US-6479495-B1 SIMULTANEOUSLY TREATING DEPRESSION AND MEMORY DYSFUNCTION IN MAMMALS SUFFERING FROM MEMORY DYSFUNCTION AND DEPRESSION AVENTIS PHARMACEUTICALS INC. 2002-11-12 US disclosed
EP-1032559-A1 AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2000-09-06 EP disclosed
WO-1999016746-A1 AMINOALKYLPHENOL DERIVATIVES AND RELATED COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 1999-04-08 WO disclosed