SCHEMBL6813893

SCHEMBL6813893

CN(C)C(=O)c1cc(CCBr)ccc1OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 4/20 0.55
FFAR4 Q5NUL3 1/20 0.50
BRD4 O60885 1/20 0.47
FFAR1 O14842 1/20 0.47
LRRK2 Q5S007 2/20 0.47
APP P05067 2/20 0.46
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
MTNR1A P48039 2/20 0.44
MTNR1B P49286 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
BLM P54132 1/20 0.44
LTB4R Q15722 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
SCHEMBL6812441 0.89 FOLH1 (0.53) FOLH1FFAR4BRD4FFAR1LRRK2
SCHEMBL27820729 0.84 FOLH1 (0.56) FOLH1FFAR4FFAR1LRRK2APP
SCHEMBL12726937 0.80 TRPM8 (0.58) BRD4ALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL13643136 0.79 FOLH1 (0.48) FOLH1FFAR4BRD4LRRK2APP
SCHEMBL14870834 0.79 FOLH1 (0.48) FOLH1FFAR4BRD4LRRK2APP
SCHEMBL6810024 0.78 ABCB1 (0.46) KDM4EALDH1A1MEN1KMT2A
SCHEMBL1646958 0.78 LRRK2 (0.63) FOLH1BRD4LRRK2KDM4EALDH1A1
SCHEMBL10214905 0.78 FOLH1 (0.47) FOLH1FFAR4BRD4LRRK2APP
SCHEMBL2617285 0.78 FOLH1 (0.47) FOLH1FFAR4BRD4LRRK2APP
SCHEMBL6814409 0.78 KDM4E (0.54) FOLH1BRD4LRRK2APPKDM4E

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