SCHEMBL12836715

SCHEMBL12836715

C=CC(=O)Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.62
ABCC4 O15439 1/20 0.62
GAA P10253 1/20 0.62
TSHR P16473 1/20 0.62
PTGS1 P23219 1/20 0.62
HTT P42858 1/20 0.62
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.51
ALDH1A1 P00352 4/20 0.50
FFAR1 O14842 2/20 0.48
HPGD P15428 2/20 0.47
AKT1 P31749 1/20 0.45
MAPT P10636 2/20 0.45
NR1H4 Q96RI1 1/20 0.45
SRD5A2 P31213 1/20 0.44
SLC6A2 P23975 1/20 0.44
SLC6A3 Q01959 1/20 0.44
BCHE P06276 1/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43

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
SCHEMBL14889158 0.92 LMNA (0.48) LMNAABCC4GAATSHRPTGS1
SCHEMBL669706 0.88 CES1 (0.56) LMNAABCC4GAATSHRPTGS1
Ammonia Solution, Strong SCHEMBL11111905 0.86 CES1 (0.54) LMNAABCC4GAATSHRPTGS1
SCHEMBL12811177 0.85 LMNA (0.48) LMNAABCC4GAATSHRPTGS1
Oxalic Acid SCHEMBL29268820 0.84 CES1 (0.52) LMNAABCC4GAATSHRPTGS1
SCHEMBL7103949 0.82 LMNA (0.64) LMNAABCC4GAATSHRPTGS1
SCHEMBL14889271 0.81 ABCC4 (0.41) LMNAABCC4GAATSHRPTGS1
SCHEMBL20733435 0.80 ALDH1A1 (0.42) LMNAABCC4GAATSHRPTGS1
SCHEMBL14192325 0.80 THRB (0.62) KMT2AMEN1ALDH1A1HPGDMAPT
SCHEMBL12810921 0.80 SRD5A2 (0.57) GAAHTTFFAR1SRD5A2

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
WO-2011027902-A1 BARRIER LAMINATE, GAS BARRIER FILM AND METHOD FOR MANUFACTURING THE BARRIER LAMINATE FUJIFILM CORPORATION (JP) 2011-03-10 WO disclosed