SCHEMBL5570026

SCHEMBL5570026

CCCC(=O)c1cc(Cl)ccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.57
FEN1 P39748 1/20 0.57
ALDH1A1 P00352 7/20 0.56
LMNA P02545 3/20 0.56
MAPT P10636 1/20 0.56
TP53 P04637 2/20 0.55
TSHR P16473 3/20 0.54
ALOX15 P16050 3/20 0.47
RECQL P46063 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
HPGD P15428 2/20 0.47
HSD17B10 Q99714 1/20 0.47
POLB P06746 2/20 0.46
THRB P10828 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPK1 P28482 1/20 0.46
HIF1A Q16665 1/20 0.46
NOS2 P35228 2/20 0.46
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46

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
SCHEMBL17746129 0.88 ERCC5 (0.53) ERCC5FEN1ALDH1A1LMNAMAPT
SCHEMBL2125979 0.85 ALDH1A1 (0.65) ERCC5FEN1ALDH1A1LMNAMAPT
SCHEMBL16770754 0.85 ERCC5 (0.61) ERCC5FEN1ALDH1A1LMNAMAPT
SCHEMBL1024674 0.84 RAB9A (0.49) ERCC5FEN1ALDH1A1LMNAMAPT
SCHEMBL14050306 0.84 POLB (0.55) ALDH1A1LMNAMAPTTSHRALOX15
SCHEMBL1427082 0.83 ERCC5 (0.59) ERCC5FEN1ALDH1A1LMNAMAPT
SCHEMBL6744199 0.82 F2R (0.56) ERCC5FEN1ALDH1A1LMNAMAPT
SCHEMBL13265174 0.82 TSHR (0.51) ERCC5FEN1ALDH1A1LMNAMAPT
SCHEMBL2081805 0.82 NOS2 (0.65) ALDH1A1TSHRALOX15RECQLTDP1
SCHEMBL31661713 0.81 ERCC5 (0.62) ERCC5FEN1ALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1745004-B1 ARYL KETONE COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECH INC (US) 2016-05-18 EP disclosed
EP-1745004-A4 ARYL KETONE COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECH INC (US) 2007-05-09 EP disclosed
EP-1745004-A2 ARYL KETONE COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS Emisphere Technologies, Inc. (US) 2007-01-24 EP disclosed
WO-2005117854-A2 ARYL KETONE COMPOUNDS AND COMPOSITIONS FOR DELIVERING ACTIVE AGENTS EMISPHERE TECHNOLOGIES, INC. (US) 2005-12-15 WO disclosed
WO-2000075094-A2 METHOD FOR PRODUCING A HALOGENATED ACETOPHENONE ISHIHARA SANGYO KAISHA, LTD. (JP) 2000-12-14 WO disclosed