Naphthalene

Naphthalene

SCHEMBL2270334

c1ccc2c3ccc-3c2c1.c1ccc2ccccc2c1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 6/20 0.61
ALOX12 P18054 2/20 0.61
ALDH1A1 P00352 8/20 0.56
HSD17B10 Q99714 6/20 0.56
TSHR P16473 5/20 0.56
TDP1 Q9NUW8 1/20 0.56
HPRT1 P00492 1/20 0.50
CYP1A2 P05177 5/20 0.45
HPGD P15428 4/20 0.45
HIF1A Q16665 3/20 0.45
CYP1B1 Q16678 1/20 0.45
THRB P10828 1/20 0.45
CYP3A4 P08684 1/20 0.43
KEAP1 Q14145 1/20 0.43
DNMT1 P26358 1/20 0.42
MAPK1 P28482 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
CASP1 P29466 1/20 0.40
PTPN22 Q9Y2R2 1/20 0.39

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
Ammonia Solution, Strong SCHEMBL3586937 0.84 ALDH1A1 (0.44) CYP2A6ALOX12ALDH1A1HSD17B10TSHR
SCHEMBL6077039 0.83 ALDH1A1 (0.56) CYP2A6ALDH1A1HSD17B10TSHRTDP1
SCHEMBL25302086 0.79 ALDH1A1 (0.59) CYP2A6ALDH1A1HSD17B10TSHRTDP1
SCHEMBL27953 0.79 ALDH1A1 (0.59) CYP2A6ALDH1A1HSD17B10TSHRTDP1
Naphthalene SCHEMBL8953 0.78 CYP2A6 (1.00) CYP2A6ALOX12ALDH1A1HSD17B10TSHR
Naphthalene SCHEMBL1331142 0.78 CYP2A6 (1.00) CYP2A6ALOX12ALDH1A1HSD17B10TSHR
Naphthalene SCHEMBL1330659 0.78 CYP2A6 (1.00) CYP2A6ALOX12ALDH1A1HSD17B10TSHR
Naphthalene SCHEMBL1332240 0.78 CYP2A6 (1.00) CYP2A6ALOX12ALDH1A1HSD17B10TSHR
Naphthalene SCHEMBL8613802 0.78 CYP2A6 (1.00) CYP2A6ALOX12ALDH1A1HSD17B10TSHR
Naphthalene SCHEMBL29358073 0.78 CYP2A6 (1.00) CYP2A6ALOX12ALDH1A1HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8071769-B2 Aromatic monomer- and conjugated polymer-metal complexes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-12-06 US disclosed
US-20110172426-A1 AROMATIC MONOMER- AND CONJUGATED POLYMER-METAL COMPLEXES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-14 US disclosed
US-20100160631-A1 AROMATIC MONOMER- AND CONJUGATED POLYMER-METAL COMPLEXES SUMITOMO CHEMICHAL COMPANY, LIMITED (JP) 2010-06-24 US disclosed
US-7705528-B2 Aromatic monomer-and conjugated polymer-metal complexes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-27 US disclosed
US-7651746-B2 Halogenated bisdiarylaminopolycyclic aromatic compounds and polymers thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-01-26 US disclosed
US-7399504-B2 Method of preparing an insoluble polymer film on a substrate from a soluble polymer containing labile solubilizing groups DOW GLOBAL TECHNOLOGIES INC. (US) 2008-07-15 US disclosed
US-20070126345-A1 Halogenated bisdiarylaminopolycylic aromatic compounds and polymers thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-06-07 US disclosed
WO-2005049546-A1 HALOGENATED BISDIARYLAMINOPOLYCYLIC AROMATIC COMPOUNDS AND POLYMERS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-06-02 WO disclosed
US-20050106324-A1 Method of preparing an insoluble polymer film on a substrate from a soluble polymer containing labile solubilizing groups DOW GLOBAL TECHNOLOGIES LLC 2005-05-19 US disclosed
WO-2005036666-A2 METHOD OF PREPARING AN INSOLUBLE POLYMER FILM ON A SUBSTRATE FROM A SOLUBLE POLYMER CONTAINING LABILE SOLUBILIZING GROUPS DOW GLOBAL TECHNOLOGIES INC. (US) 2005-04-21 WO disclosed
WO-2005016945-A1 AROMATIC MONOMER-AND CONJUGATED POLYMER-METAL COMPLEXES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-02-24 WO disclosed
US-20050031900-A1 Aromatic monomer-and conjugated polymer-metal complexes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-02-10 US disclosed
WO-2005010081-A1 AROMATIC MONOMER-AND CONJUGATED POLYMER-METAL COMPLEXES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-02-03 WO disclosed
US-20050014023-A1 Aromatic monomer- and conjugated polymer-metal complexes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2005-01-20 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100160631-A1 AROMATIC MONOMER- AND CONJUGATED POLYMER-METAL COMPLEXES DDT, TYR, DDC CYP2A6 4047/4885ALOX12 3061/4885ALDH1A1 2113/4885
US-20110172426-A1 AROMATIC MONOMER- AND CONJUGATED POLYMER-METAL COMPLEXES DDT, TYR, DDC CYP2A6 4047/4885ALOX12 3061/4885ALDH1A1 2113/4885
US-20070126345-A1 Halogenated bisdiarylaminopolycylic aromatic compounds and polymers thereof AHR, AADAC, ARNT CYP2A6 168/4885ALOX12 313/4885ALDH1A1 667/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.