SCHEMBL4480225

SCHEMBL4480225

CCCC(OC)c1cccc2ccccc12.[LiH]

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.59
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
SLC6A4 P31645 3/20 0.43
ADRA2A P08913 2/20 0.41
ADRA2B P18089 2/20 0.41
ADRA2C P18825 2/20 0.41
SLC6A2 P23975 1/20 0.39
HTR1D P28221 1/20 0.38
HTR1B P28222 1/20 0.38
KMT2A Q03164 1/20 0.38
GAA P10253 1/20 0.37

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
SCHEMBL15750826 0.83 AOC3 (0.59) AOC3ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL27458634 0.83 AOC3 (0.59) AOC3ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL29481516 0.83 AOC3 (0.59) AOC3ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL14876596 0.83 AOC3 (0.59) AOC3ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL9572588 0.80 AOC3 (0.44) AOC3ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL7109903 0.80 AOC3 (0.44) AOC3ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL7196888 0.79 AOC3 (0.62) AOC3ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL8375755 0.79 AOC3 (0.62) AOC3ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL28994581 0.79 AOC3 (0.62) AOC3ALDH1A1CYP1A2CYP2C9CYP2C19
Iodide SCHEMBL25290234 0.78 AOC3 (0.65) AOC3ALDH1A1CYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8187740-B2 3-D microbatteries based on interlaced micro-container structures TEL AVIV UNIVERSITY FUTURE TECHNOLOGY DEVELOPMENT L.P. (IL) 2012-05-29 US disclosed
US-20090142656-A1 3-D MICROBATTERIES BASED ON INTERLACED MICRO-CONTAINER STRUCTURES TEL AVIV UNIVERSITY FUTURE TECHNOLOGY DEVELOPMENT L.P. (IL) 2009-06-04 US disclosed