SCHEMBL14700324

SCHEMBL14700324

CC(C)(O)C(=O)c1cc(CO)cc(CO)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PRKCA P17252 3/20 0.37
▸ PRKCD Q05655 3/20 0.37
▸ ACHE P22303 1/20 0.34
▸ PPARG P37231 1/20 0.34
▸ PPARA Q07869 1/20 0.34
▸ EPHX2 P34913 1/20 0.34
▸ PDK1 Q15118 1/20 0.34
▸ PDK2 Q15119 1/20 0.34
▸ PDK3 Q15120 1/20 0.34
▸ PDK4 Q16654 1/20 0.34
▸ CYP4F2 P78329 1/20 0.33
▸ CYP4A11 Q02928 1/20 0.33
▸ ACE2 Q9BYF1 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ CASP6 P55212 1/20 0.31

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
SCHEMBL14686062 0.86 CA1 (0.35) —
SCHEMBL31229898 0.81 PRSS1 (0.49) PRKCAPRKCDACHEPDK1PDK2
SCHEMBL14686042 0.81 PRSS1 (0.49) PRKCAPRKCDACHEPDK1PDK2
SCHEMBL14700259 0.81 CA1 (0.32) —
SCHEMBL480503 0.79 EPHX2 (0.49) PPARGPPARAEPHX2ACE2
SCHEMBL31393489 0.75 LMNA (0.44) EPHX2PDK1PDK2PDK3PDK4
SCHEMBL6163099 0.73 PRSS1 (0.42) PRKCAPRKCDACHEMAPTKDM4E
SCHEMBL12253687 0.73 CA5A (0.48) PRKCAPRKCDACHECYP4F2CYP4A11
SCHEMBL23090443 0.72 SLC7A5 (0.47) PRKCAPRKCDPPARGPPARACYP4F2
SCHEMBL3671847 0.71 ACE2 (0.45) ACHEEPHX2ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2557072-B1 PARA- OR MESO-FUNCTIONALIZED AROMATIC KETONE COMPOUNDS, PREPARATION METHODS THEREOF, AND PHOTOPOLYMERIZATION INITIATORS COMPRISING THE SAME SHENZHEN UV-CHEMTECH CO LTD (CN) 2017-09-20 — — EP disclosed
US-8742175-B2 Para—or meso-functionalized aromatic ketone compounds, preparation methods thereof, and photopolymerization initiators comprising the same Shenzhen UV-Chemtech Co., Ltd. (CN) 2014-06-03 — — US disclosed
US-8742175-B2 Para—or meso-functionalized aromatic ketone compounds, preparation methods thereof, and photopolymerization initiators comprising the same Shenzhen UV-Chemtech Co., Ltd. (CN) 2014-06-03 — — US disclosed
US-20130217877-A1 PARA- OR MESO-FUNCTIONALIZED AROMATIC KETONE COMPOUNDS, PREPARATION METHODS THEREOF, AND PHOTOPOLYMERIZATION INITIATORS COMPRISING THE SAME SHENZHEN UV-CHEMTECH CO., LTD (CN) 2013-08-22 — — US disclosed
US-20130217877-A1 PARA- OR MESO-FUNCTIONALIZED AROMATIC KETONE COMPOUNDS, PREPARATION METHODS THEREOF, AND PHOTOPOLYMERIZATION INITIATORS COMPRISING THE SAME SHENZHEN UV-CHEMTECH CO., LTD (CN) 2013-08-22 — — US disclosed
EP-2557072-A1 PARA- OR MESO-FUNCTIONALIZED AROMATIC KETONE COMPOUNDS, PREPARATION METHODS THEREOF, AND PHOTOPOLYMERIZATION INITIATORS COMPRISING THE SAME Shenzhen UV-Chemtech Co., Ltd (CN) 2013-02-13 — — EP disclosed
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