SCHEMBL7135641

SCHEMBL7135641

CCCC(C=O)(CC)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
THRB P10828 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL3947952 0.91 FFAR3 (0.32) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL4706953 0.85 MEN1 (0.33) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL6154156 0.84 CES2 (0.40) MEN1ALDH1A1KMT2A
SCHEMBL6155159 0.84 CES2 (0.40) MEN1ALDH1A1KMT2A
SCHEMBL31143106 0.79 CA1 (0.30)
SCHEMBL6024752 0.79 ALDH1A1 (0.34) ALDH1A1
SCHEMBL15442719 0.78 MEN1 (0.31) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL10447893 0.77 CYP2D6 (0.41) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL28299078 0.74 CES2 (0.42) MEN1ALDH1A1KMT2A
SCHEMBL15442979 0.73

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-1169290-B1 PROCESS TO SEPARATE LINEAR ALKYL 5-FORMYLVALERATE DSM IP ASSETS BV (NL) 2003-11-12 EP claimed
CN-1766733-A Phototonus resin composition, spacer for display panel and display panel JSR CORP (JP) 2006-05-03 CN disclosed