SCHEMBL16347333

SCHEMBL16347333

C=CC(C(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.56
ALDH1A1 P00352 5/20 0.53
LMNA P02545 3/20 0.53
TDP1 Q9NUW8 2/20 0.52
MAPK1 P28482 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A3 Q01959 1/20 0.52
KMT2A Q03164 1/20 0.52
AKR1B10 O60218 2/20 0.49
AKR1B1 P15121 2/20 0.49
CA12 O43570 2/20 0.49
CA9 Q16790 2/20 0.49
CA4 P22748 1/20 0.49
CA6 P23280 1/20 0.49
CA5A P35218 1/20 0.49
CA7 P43166 1/20 0.49
CA14 Q9ULX7 1/20 0.49
CA5B Q9Y2D0 1/20 0.49
TGM2 P21980 1/20 0.47

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
SCHEMBL16347332 0.93 HCAR2 (0.53) HCAR2ALDH1A1LMNATDP1MAPK1
SCHEMBL27397144 0.82 ALDH1A1 (0.55) HCAR2ALDH1A1LMNATDP1MAPK1
SCHEMBL8025769 0.82 ALDH1A1 (0.50) HCAR2ALDH1A1LMNATDP1MAPK1
SCHEMBL9059119 0.82 ALDH1A1 (0.50) HCAR2ALDH1A1LMNATDP1MAPK1
SCHEMBL614051 0.82 ALDH1A1 (0.55) HCAR2ALDH1A1LMNATDP1MAPK1
SCHEMBL8798874 0.82 ALDH1A1 (0.50) HCAR2ALDH1A1LMNATDP1MAPK1
SCHEMBL616503 0.80 ALDH1A1 (0.51) HCAR2ALDH1A1LMNATDP1MAPK1
SCHEMBL616964 0.80 ALDH1A1 (0.51) HCAR2ALDH1A1LMNATDP1MAPK1
SCHEMBL19105307 0.79 ALDH1A1 (0.50) HCAR2ALDH1A1LMNATDP1MAPK1
SCHEMBL24012024 0.78 ALDH1A1 (0.50) HCAR2ALDH1A1LMNATDP1MAPK1

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-3016938-A2 BIOBASED EPOXIDIZED FATTY ACID ESTER PLASTICIZERS Polymer Additives, Inc. (US) 2016-05-11 EP claimed
WO-2015002746-A2 BIOBASED EPOXIDIZED FATTY ACID ESTER PLASTICIZERS FERRO CORPORATION (US) 2015-01-08 WO claimed
EP-3016938-A2 BIOBASED EPOXIDIZED FATTY ACID ESTER PLASTICIZERS Polymer Additives, Inc. (US) 2016-05-11 EP disclosed
WO-2015002746-A2 BIOBASED EPOXIDIZED FATTY ACID ESTER PLASTICIZERS FERRO CORPORATION (US) 2015-01-08 WO disclosed