SCHEMBL7957581

SCHEMBL7957581

CCOOCc1ccc(B(O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.57
LIPG Q9Y5X9 7/20 0.57
CA2 P00918 5/20 0.50
CA1 P00915 4/20 0.50
TRPV1 Q8NER1 1/20 0.47
MGLL Q99685 1/20 0.47
F11 P03951 1/20 0.45
ENPP2 Q13822 3/20 0.43
TSHR P16473 1/20 0.37
TTR P02766 1/20 0.36

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
SCHEMBL13978537 0.82 LPL (0.59) LPLLIPGCA2CA1TRPV1
SCHEMBL13644300 0.82 LPL (0.54) LPLLIPGCA2CA1TRPV1
SCHEMBL13189266 0.79 IDO1 (0.50) CA2CA1
SCHEMBL8180214 0.77 LPL (0.53) LPLLIPGCA2CA1TRPV1
SCHEMBL104085 0.77 LPL (0.58) LPLLIPGCA2CA1TRPV1
SCHEMBL150306 0.73 LPL (1.00) LPLLIPGCA2CA1TRPV1
SCHEMBL10091444 0.72 CYP3A4 (0.52)
SCHEMBL7706546 0.72 TRPA1 (0.39) TSHR
SCHEMBL12626829 0.72 IDO1 (0.52)
SCHEMBL12824780 0.72 TSHR (0.46) TSHR

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
WO-2009137499-A1 INHIBITORS OF HISTONE DEACETYLASE ENVIVO PHARMACEUTICALS, INC. (US) 2009-11-12 WO disclosed
WO-2009137462-A2 METHODS FOR TREATING COGNITIVE DISORDERS USING INHIBITORS OF HISTONE DEACETYLASE ENVIVO PHARMACEUTICALS, INC. (US) 2009-11-12 WO disclosed
WO-2008055068-A2 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2008-05-08 WO disclosed