Naphthalene

Naphthalene

SCHEMBL2461176

[Fe]C1=CC=CC1.c1ccc2ccccc2c1

nearest known ligand 0.38

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Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.38
ALOX12 P18054 1/20 0.38
TDP1 Q9NUW8 1/20 0.31

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
Naphthalene SCHEMBL28401700 0.92 CYP2A6 (0.32) CYP2A6ALOX12
Benzene SCHEMBL2456086 0.85
SCHEMBL240820 0.84
Biphenyl SCHEMBL2460502 0.84 ALDH1A1 (0.41) TDP1
O-Xylene SCHEMBL5613076 0.84 TSHR (0.46) CYP2A6TDP1
Biphenyl SCHEMBL6315601 0.84 ALDH1A1 (0.41) TDP1
Toluene SCHEMBL2461658 0.82 LMNA (0.48) ALOX12
Methane SCHEMBL8960255 0.82
Water SCHEMBL2455729 0.82
SCHEMBL28154044 0.82

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-102214803-B Packaging method of photoelectronic device UNIV ELECTRONIC SCIENCE & TECH 2013-07-17 CN disclosed
US-8278820-B2 Active matrix organic electroluminescent device and method of manufacture thereof University of Electric Sience and Technology of China (CN) 2012-10-02 US disclosed
US-20110221331-A1 Active matrix organic electroluminescent device and method of manufacture thereof UNIVERSITY OF ELECTRONIC SCIENCE AND TECHNOLOGY OF CHINA 2011-09-15 US disclosed