SCHEMBL6809786

SCHEMBL6809786

COCOCCc1ccc(OCc2ccccc2)c(Br)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
FFAR4 Q5NUL3 1/20 0.43
KDM4E B2RXH2 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
BLM P54132 1/20 0.43
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HPGD P15428 1/20 0.41
TLR9 Q9NR96 1/20 0.41
ABCB1 P08183 2/20 0.40
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
FFAR1 O14842 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40

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
SCHEMBL6818430 0.84 FOLH1 (0.61) FFAR4KDM4EFFAR1MTNR1AMTNR1B
SCHEMBL6813896 0.82 MAOB (0.50) FFAR4
SCHEMBL6807640 0.82 SMN1; SMN2 (0.46) RAB9ASMN1; SMN2FFAR4KDM4EHPGD
SCHEMBL2172626 0.81 ABCB1 (0.39) RAB9ASMN1; SMN2FFAR4CYP1A2MEN1
SCHEMBL2173652 0.81 ABCB1 (0.38) RAB9ASMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL6812786 0.79 HTT (0.49) FFAR4KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL6809815 0.79 FOLH1 (0.49) SMN1; SMN2FFAR4KDM4EHPGDFFAR1
SCHEMBL1995693 0.78 RAB9A (0.56) RAB9ASMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10092244 0.78 RAB9A (0.45) RAB9ASMN1; SMN2KDM4EHPGDTLR9
SCHEMBL7108030 0.78 FFAR4 (0.45) RAB9ASMN1; SMN2FFAR4KDM4EMEN1

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