SCHEMBL28811398

SCHEMBL28811398

CCC(C)=C(C)CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 3/20 0.50
LDHA P00338 1/20 0.44
SRR Q9GZT4 1/20 0.44
TDP1 Q9NUW8 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
LMNA P02545 1/20 0.35
SLC15A2 Q16348 1/20 0.35
KDM4E B2RXH2 1/20 0.35
KDM6B O15054 1/20 0.35
KDM5C P41229 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
PHF8 Q9UPP1 1/20 0.35
KDM2A Q9Y2K7 1/20 0.35
CTH P32929 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 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
SCHEMBL6647501 0.87 LDHA (0.57) FFAR3LDHASRRTDP1ALDH1A1
SCHEMBL6647502 0.87 LDHA (0.57) FFAR3LDHASRRTDP1ALDH1A1
SCHEMBL1783362 0.79 ALDH1A1 (0.53) FFAR3TDP1ALDH1A1LMNASLC15A2
SCHEMBL1783361 0.79 ALDH1A1 (0.53) FFAR3TDP1ALDH1A1LMNASLC15A2
SCHEMBL10052566 0.76 FFAR3 (0.43) FFAR3LDHASRRTDP1ALDH1A1
Malonic Acid SCHEMBL3867313 0.76 LDHA (0.45) FFAR3LDHASRRTDP1ALDH1A1
SCHEMBL1537803 0.76 FFAR3 (0.43) FFAR3LDHASRRTDP1ALDH1A1
SCHEMBL1300401 0.76 FFAR3 (0.43) FFAR3LDHASRRTDP1ALDH1A1
SCHEMBL9766504 0.76 FFAR3 (0.43) FFAR3LDHASRRTDP1ALDH1A1
SCHEMBL3614641 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103739574-A Synthetic method of substitutive 5H-furan-2-ketone compound UNIV ZHEJIANG TECHNOLOGY 2014-04-23 CN disclosed