SCHEMBL28113815

SCHEMBL28113815

C=CC=CCOc1cccc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 10/20 0.49
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
KCNA3 P22001 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
OGG1 O15527 1/20 0.45
HTR1D P28221 2/20 0.45
SLC6A4 P31645 2/20 0.44
HRH1 P35367 1/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
NR2E1 Q9Y466 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
SCHEMBL9064297 0.83 HTR1B (0.51) HTR1BKDM4EALDH1A1HPGDKCNA3
SCHEMBL4371294 0.82 HPGD (0.56) HTR1BKDM4EALDH1A1HPGDKCNA3
Water SCHEMBL21694712 0.81 HPGD (0.55) HTR1BKDM4EALDH1A1HPGDKCNA3
Ethylene SCHEMBL3362752 0.81 HPGD (0.55) HTR1BKDM4EALDH1A1HPGDKCNA3
SCHEMBL1394420 0.78 HTR1B (0.58) HTR1BKDM4EALDH1A1HPGDKCNA3
SCHEMBL27656215 0.78 HTR1B (0.51) HTR1BKDM4EALDH1A1HPGDKCNA3
SCHEMBL1158047 0.77 KDM4E (0.50) HTR1BKDM4EALDH1A1HPGDKCNA3
SCHEMBL1158049 0.77 KDM4E (0.50) HTR1BKDM4EALDH1A1HPGDKCNA3
Oxirane SCHEMBL28066237 0.75 HPGD (0.50) HTR1BKDM4EALDH1A1HPGDKCNA3
SCHEMBL1306417 0.75 HTR1B (0.55) HTR1BKDM4EALDH1A1HPGDKCNA3

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
CN-106082309-B Manufacturing method, heat-releasing filler, resin combination, heat-dissipating grease and the heat-dissipating coating composition of Zinc oxide particles 堺化学工业株式会社 2018-06-08 CN disclosed
CN-104837970-B Lubricating oil composition for trunk piston type diesel engine 吉坤日矿日石能源株式会社 2018-01-09 CN disclosed
CN-106082309-A The manufacture method of Zinc oxide particles, heat-releasing filler, resin combination, heat-dissipating grease and heat-dissipating coating composition 堺化学工业株式会社 2016-11-09 CN disclosed