SCHEMBL6809927

SCHEMBL6809927

CCOC(=O)COc1cc(Cl)c(CCBr)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
TDP1 Q9NUW8 2/20 0.50
TSHR P16473 1/20 0.50
LMNA P02545 1/20 0.49
GAA P10253 3/20 0.48
PKM P14618 1/20 0.48
PPOX P50336 1/20 0.47
ABCB1 P08183 1/20 0.44
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGD P15428 2/20 0.41
CASP1 P29466 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ADRB3 P13945 2/20 0.41
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.39

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
SCHEMBL6809817 0.91 GAA (0.47) L3MBTL1TDP1TSHRLMNAGAA
SCHEMBL6813576 0.91 ABCB1 (0.43) L3MBTL1TDP1TSHRLMNAGAA
SCHEMBL6813425 0.88 LMNA (0.46) L3MBTL1TDP1TSHRLMNAGAA
SCHEMBL6813572 0.88 ALDH1A1 (0.48) L3MBTL1TDP1TSHRLMNAGAA
SCHEMBL6558629 0.82 LMNA (0.70) L3MBTL1TDP1TSHRLMNAGAA
SCHEMBL6812681 0.81 L3MBTL1 (0.50) L3MBTL1TDP1TSHRLMNAGAA
SCHEMBL6575124 0.80 GAA (0.49) LMNAGAAALDH1A1NPSR1KDM4E
SCHEMBL6818105 0.80 ADRB3 (0.57) L3MBTL1TDP1TSHRGAAPKM
SCHEMBL6813560 0.78 CYP1A2 (0.47) L3MBTL1TDP1TSHRLMNAGAA
SCHEMBL2250872 0.78 ALDH1A1 (0.44) TSHRGAAABCB1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1095932-B1 PHENOXYACETIC ACID DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME KISSEI PHARMACEUTICAL (JP) 2004-05-19 EP disclosed
US-6538152-B1 Obesity, hyperglycemia, urinary incontinence, intestinal or biliary calculi hypermotility, pollakiuria and depression treatment KISSEI PHARMACEUTICAL CO., LTD. (JP) 2003-03-25 US disclosed
EP-1095932-A1 PHENOXYACETIC ACID DERIVATIVES AND MEDICINAL COMPOSITIONS CONTAINING THE SAME Kissei Pharmaceutical Co., Ltd. (JP) 2001-05-02 EP disclosed