Naphthalene

Naphthalene

SCHEMBL15537489

CCCCCCCCO.c1ccc2ccccc2c1

nearest known ligand 0.62

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.62
ALDH1A1 P00352 4/20 0.62
TSHR P16473 3/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
HSD17B10 Q99714 2/20 0.62
SMN1; SMN2 Q16637 3/20 0.57
HTT P42858 2/20 0.48
LIPG Q9Y5X9 1/20 0.44
CETP P11597 1/20 0.44
KCNH2 Q12809 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KDM4E B2RXH2 2/20 0.43
RGS12 O14924 1/20 0.43
USP2 O75604 1/20 0.43
HSP90AA1 P07900 1/20 0.43
THRB P10828 1/20 0.43
MAPK1 P28482 1/20 0.43
RAD52 P43351 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
Nonanol SCHEMBL29217536 1.00 LMNA (0.62) LMNAALDH1A1TSHRMEN1KMT2A
Decanol SCHEMBL27731676 1.00 LMNA (0.62) LMNAALDH1A1TSHRMEN1KMT2A
Anthracene SCHEMBL27586480 0.91 LMNA (0.56) LMNAALDH1A1TSHRMEN1KMT2A
Naphthalene SCHEMBL27493313 0.90 ALDH1A1 (0.58) LMNAALDH1A1TSHRMEN1KMT2A
Naphthalene SCHEMBL11775581 0.87 HTT (0.57) LMNAALDH1A1TSHRMEN1KMT2A
Dodecane SCHEMBL27909924 0.87 HTT (0.57) LMNAALDH1A1TSHRMEN1KMT2A
Tetradecane SCHEMBL9931457 0.87 HTT (0.57) LMNAALDH1A1TSHRMEN1KMT2A
Decane SCHEMBL11776802 0.87 HTT (0.57) LMNAALDH1A1TSHRMEN1KMT2A
Naphthalene SCHEMBL9764137 0.87 HTT (0.57) LMNAALDH1A1TSHRMEN1KMT2A
Naphthalene SCHEMBL11775588 0.87 HTT (0.57) LMNAALDH1A1TSHRMEN1KMT2A

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
US-9782748-B2 Synthesis of polymeric ionic liquids using a photochemical polymerization process THE UNIVERSITY OF TOLEDO (US) 2017-10-10 US disclosed
US-20150119231-A1 Synthesis of Polymeric Ionic Liquids Using a Photochemical Polymerization Process THE UNIVERSITY OF TOLEDO (US) 2015-04-30 US disclosed
WO-2013181345-A2 SYNTHESIS OF POLYMERIC IONIC LIQUIDS USING A PHOTOCHEMICAL POLYMERIZATION PROCESS THE UNIVERSITY OF TOLEDO (US) 2013-12-05 WO disclosed