SCHEMBL69947

SCHEMBL69947

O=[N+]([O-])c1cc(O)ccc1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.67
GPR35 Q9HC97 2/20 0.67
TP53 P04637 2/20 0.67
HPGD P15428 2/20 0.67
TSHR P16473 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
ALDH1A1 P00352 1/20 0.67
L3MBTL1 Q9Y468 2/20 0.64
ALOX15 P16050 1/20 0.64
HSD17B10 Q99714 1/20 0.64
ALDH5A1 P51649 1/20 0.60
ABAT P80404 1/20 0.60
CA12 O43570 1/20 0.60
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
CA9 Q16790 1/20 0.60
EGFR P00533 2/20 0.58
MAPT P10636 3/20 0.58
KDM4E B2RXH2 2/20 0.58
USP2 O75604 1/20 0.58

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
SCHEMBL6031674 1.00 MAPK1 (0.67) MAPK1GPR35TP53HPGDTSHR
SCHEMBL29502912 1.00 MAPK1 (0.67) MAPK1GPR35TP53HPGDTSHR
Methoxymethane SCHEMBL10630276 0.92 MAPK1 (0.58) MAPK1GPR35TP53HPGDTSHR
Sulfuric Acid SCHEMBL31742448 0.92 CA12 (0.62) MAPK1GPR35TP53HPGDTSHR
SCHEMBL29484216 0.86 MAPT (0.71) MAPK1GPR35TP53HPGDTSHR
SCHEMBL213758 0.84 TSHR (0.56) MAPK1GPR35TP53HPGDTSHR
SCHEMBL29577003 0.84 TSHR (0.56) MAPK1GPR35TP53HPGDTSHR
2,4-Dinitrophenol SCHEMBL11186956 0.82 ALDH1A1 (0.85) MAPK1GPR35TP53HPGDTSHR
SCHEMBL6796101 0.82 ESR1 (0.57) MAPK1GPR35TP53HPGDTSHR
SCHEMBL68980 0.82 GPR35 (0.67) MAPK1GPR35TP53HPGDTSHR

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 371 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117209746-A Silane end capped polyether resin and preparation method and application thereof 江西蓝星星火有机硅有限公司 2023-12-12 CN claimed
US-11597829-B2 Resin composition for fiber-reinforced composite materials and fiber-reinforced composite material using same NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2023-03-07 US claimed
CN-105547774-B A method of roxarsone and its catabolite in separation broiler chicken excrement 北京市农林科学院 2018-11-06 CN claimed
WO-2018002173-A1 METHOD OF DETECTING COPD BY MASS SPECTROMETRY ETH ZURICH (CH) 2018-01-04 WO claimed
US-9695278-B2 Polyester co-phosphonates FRX POLYMERS, INC. (US) 2017-07-04 US claimed
US-20150136150-A1 DURABLE SKIN MARKING COMPOSITIONS OP-MARKS, INC. (GA) 2015-05-21 US claimed
EP-2867272-A1 POLYESTER CO-PHOSPHONATES FRX Polymers, Inc. (US) 2015-05-06 EP claimed
WO-2014005136-A1 POLYESTER CO-PHOSPHONATES FRX POLYMERS, INC. (US) 2014-01-03 WO claimed
US-20140000751-A1 POLYESTER CO-PHOSPHONATES DOSKOCIL MANUFACTURING COMPANY, INC. 2014-01-02 US claimed
WO-2013067510-A1 DURABLE SKIN MARKING COMPOSITIONS OP- MARKS, INC. (US) 2013-05-10 WO claimed
WO-2010126883-A1 DURABLE SKIN MARKING COMPOSITIONS GEORGIA TECH RESEARCH CORPORATION (US) 2010-11-04 WO claimed
US-7807613-B2 Aqueous buffered fluoride-containing etch residue removers and cleaners AIR PRODUCTS AND CHEMICALS, INC. (US) 2010-10-05 US claimed
US-7539006-B2 Electrolytic solution for driving electrolytic capacitor and electrolytic capacitor RUBYCON CORPORATION (JP) 2009-05-26 US claimed
US-20070029529-A1 Electrolytic solution for driving electrolytic capacitor and electrolytic capacitor KOMATSU AKIHIKO 2007-02-08 US claimed
US-20040266637-A1 Aqueous buffered fluoride-containing etch residue removers and cleaners VERSUM MATERIALS US, LLC 2004-12-30 US claimed
US-20040245105-A1 Electrolyte solution for driving electrolytic capacitor and electrolytic capacitor RUBYCON CORPORATION (JP) 2004-12-09 US claimed
EP-1437749-A1 ELECTROLYTE SOLUTION FOR DRIVING ELECTROLYTIC CAPACITOR AND ELECTROLYTIC CAPACITOR Rubycon Corporation (JP) 2004-07-14 EP claimed
US-5099057-A Nitration, hydrolysis and reduction THE DOW CHEMICAL COMPANY (US) 1992-03-24 US claimed
US-4782132-A Process for producing a copolyester MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1988-11-01 US claimed
US-4487975-A Etherification of phenols RHONE-POULENC INDUSTRIES (FR) 1984-12-11 US claimed