SCHEMBL30883281

SCHEMBL30883281

Brc1ccccc1OCCCCCCOc1ccccc1Br

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.62
RAB9A P51151 6/20 0.56
NPC1 O15118 5/20 0.56
MAPT P10636 7/20 0.54
KDM4E B2RXH2 5/20 0.54
L3MBTL1 Q9Y468 4/20 0.54
LMNA P02545 3/20 0.54
HPGD P15428 3/20 0.54
CYP1A2 P05177 2/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2C19 P33261 2/20 0.54
ALDH1A1 P00352 4/20 0.54
SMN1; SMN2 Q16637 5/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
HTT P42858 1/20 0.53
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
CYP3A4 P08684 1/20 0.49

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
SCHEMBL2344935 0.98 HTR7 (0.64) HTR7RAB9ANPC1MAPTKDM4E
SCHEMBL701534 0.93 HTR7 (0.64) HTR7RAB9ANPC1MAPTKDM4E
SCHEMBL12370648 0.92 HTR7 (0.55) HTR7RAB9ANPC1MAPTKDM4E
SCHEMBL10798879 0.90 HTR7 (0.67) HTR7RAB9ANPC1MAPTKDM4E
SCHEMBL1305347 0.90 HTR7 (0.58) HTR7RAB9ANPC1MAPTKDM4E
SCHEMBL12704119 0.90 HTR7 (0.58) HTR7RAB9ANPC1MAPTKDM4E
SCHEMBL10429651 0.90 HTR7 (0.58) HTR7RAB9ANPC1MAPTKDM4E
SCHEMBL1590919 0.90 HTR7 (0.58) HTR7RAB9ANPC1MAPTKDM4E
SCHEMBL4800847 0.90 HTR7 (0.58) HTR7RAB9ANPC1MAPTKDM4E
SCHEMBL10367492 0.89 HTR7 (0.56) HTR7RAB9ANPC1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117964652-A Tetradentate phenol ether ligand-metal complex derived from naphthol, preparation method and olefin polymerization method 中国科学院大连化学物理研究所 2024-05-03 CN disclosed