SCHEMBL83798

SCHEMBL83798

O=[N+]([O-])c1ccc(Cc2ccc([N+](=O)[O-])cc2O)c(O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 3/20 0.60
ALDH1A1 P00352 5/20 0.55
TSHR P16473 4/20 0.55
HPGD P15428 2/20 0.55
MAPK1 P28482 2/20 0.55
TP53 P04637 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
GAA P10253 1/20 0.53
THRB P10828 1/20 0.53
CYP1A2 P05177 2/20 0.50
ERN1 O75460 1/20 0.50
SNCA P37840 1/20 0.50
ALOX15 P16050 2/20 0.47
HIF1A Q16665 2/20 0.46
HSD17B10 Q99714 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
TTR P02766 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL1091651 0.86 GPR35 (0.58) GPR35ALDH1A1TSHRHPGDMAPK1
SCHEMBL1531285 0.86 GPR35 (0.58) GPR35ALDH1A1TSHRHPGDMAPK1
SCHEMBL7876386 0.85 GPR35 (0.56) GPR35ALDH1A1TSHRHPGDMAPK1
SCHEMBL6691566 0.85 GPR35 (0.56) GPR35ALDH1A1TSHRHPGDMAPK1
SCHEMBL17627174 0.85 GPR35 (0.56) GPR35ALDH1A1TSHRHPGDMAPK1
SCHEMBL51277 0.84 GPR35 (0.60) GPR35ALDH1A1TSHRHPGDMAPK1
SCHEMBL28128307 0.84 GPR35 (0.51) GPR35ALDH1A1TSHRHPGDMAPK1
SCHEMBL6037267 0.83 CYP1A2 (0.73) GPR35ALDH1A1TSHRHPGDMAPK1
SCHEMBL27496676 0.83 TSHR (0.55) GPR35ALDH1A1TSHRHPGDMAPK1
Hydrochloric Acid SCHEMBL1097637 0.80 GPR35 (0.51) GPR35ALDH1A1TSHRHPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181853-B1 Thermosensitive recording medium JUJO PAPER CO LTD (JP) 2015-09-23 EP disclosed
US-8492308-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2013-07-23 US disclosed
US-8129307-B2 Thermosensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2012-03-06 US disclosed
US-20110269622-A1 THERMOSENSITIVE RECORDING MEDIUM NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2011-11-03 US disclosed
US-20110130281-A1 THERMOSENSITIVE RECORDING MEDIUM API CORPORATION 2011-06-02 US disclosed
EP-2112001-B1 THERMOSENSITIVE RECORDING MEDIUM JUJO PAPER CO LTD (JP) 2011-05-11 EP disclosed
EP-2261045-A1 HEAT-SENSITIVE RECORDING MEDIUM Nippon Paper Industries Co., Ltd. (JP) 2010-12-15 EP disclosed
EP-2181853-A1 THERMAL RECORDING MATERIAL Nippon Paper Industries Co., Ltd. (JP) 2010-05-05 EP disclosed
US-20100099557-A1 Thermosensitive Recording Medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2010-04-22 US disclosed
US-7141359-B2 Developers for thermal recording materials and thermal recording materials API CORPORATION (JP) 2006-11-28 US disclosed
US-20050118526-A1 Developers for thermal recording materials and thermal recording materials MITSUBISHI CHEMICAL CORPORATION (JP) 2005-06-02 US disclosed
EP-1393923-A1 DEVELOPERS FOR THERMAL RECORDING MATERIALS AND THERMAL RECORDING MATERIALS API Corporation (JP) 2004-03-03 EP disclosed