SCHEMBL227018

SCHEMBL227018

O=[N+]([O-])c1cc([N+](=O)[O-])c([N+](=O)[O-])cc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 6/20 0.56
MAPK1 P28482 3/20 0.56
ALDH1A1 P00352 3/20 0.56
HPGD P15428 2/20 0.56
TP53 P04637 1/20 0.56
TSHR P16473 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
SNCA P37840 1/20 0.56
ALOX15 P16050 3/20 0.54
HSD17B10 Q99714 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
KDM4E B2RXH2 3/20 0.50
MAPT P10636 3/20 0.50
ALOX12 P18054 2/20 0.50
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
CYP3A4 P08684 1/20 0.50
ALDH5A1 P51649 1/20 0.50

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
SCHEMBL16974397 1.00 GPR35 (0.56) GPR35MAPK1ALDH1A1HPGDTP53
SCHEMBL11835122 0.95 GPR35 (0.60) GPR35MAPK1ALDH1A1HPGDTP53
SCHEMBL70180 0.92 GPR35 (0.58) GPR35MAPK1ALDH1A1HPGDTP53
Barium SCHEMBL30132382 0.90 GPR35 (0.56) GPR35MAPK1ALDH1A1HPGDTP53
SCHEMBL10575433 0.90 SNCA (0.61) GPR35MAPK1ALDH1A1HPGDTP53
SCHEMBL30427268 0.90 GPR35 (0.56) GPR35MAPK1ALDH1A1HPGDTP53
Hydrochloric Acid SCHEMBL28623609 0.90 GPR35 (0.56) GPR35MAPK1ALDH1A1HPGDTP53
Potassium SCHEMBL30132355 0.90 GPR35 (0.56) GPR35MAPK1ALDH1A1HPGDTP53
SCHEMBL70858 0.89 SNCA (0.67) GPR35MAPK1ALDH1A1HPGDTP53
Methane SCHEMBL27364322 0.87 SNCA (0.59) GPR35MAPK1ALDH1A1HPGDTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9815175-B2 Abrasive entrainment waterjet cutting G.D.O. INC (US) 2017-11-14 US claimed
US-9744645-B2 Abrasive entrainment waterjet cutting G.D.O. Inc. (US) 2017-08-29 US claimed
US-20170151650-A1 Abrasive Entrainment Waterjet Cutting G.D.O. INC D/B/A GRADIENT TECHNOLOGY 2017-06-01 US claimed
US-20170151651-A1 Abrasive Entrainment Waterjet Cutting G.D.O. INC D/B/A GRADIENT TECHNOLOGY 2017-06-01 US claimed
US-9446500-B2 Underwater abrasive entrainment waterjet cutting method G.D.O. Inc. (US) 2016-09-20 US claimed
CN-102070462-A Ethylenediamine-nitrophenol type ionic liquids and preparation method thereof INST PROCESS ENG CAS 2011-05-25 CN claimed
US-7225716-B1 Process for removing the fuze from explosive projectiles using fluid jet technology GRADIENT TECHNOLOGY (US) 2007-06-05 US claimed
WO-2001088463-A2 PROCESS FOR REMOVING THE FUZES FROM EXPLOSIVE PROJECTILES GRADIENT TECHNOLOGY (US) 2001-11-22 WO claimed
EP-0039829-A1 Process for preparing electroconductive soluble heteropolyphenylenes and their use in electrotechnics and for the antistatic equipment of synthetic materials BASF Aktiengesellschaft (DE) 1981-11-18 EP claimed
US-20220143094-A1 CHIMERIC RECEPTOR THAT RECOGNIZES ENGINEERED SITE IN ANTIBODY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-05-12 US disclosed
EP-3957325-A1 CHIMERIC RECEPTOR RECOGNIZING MODIFICATION SITE OF ANTIBODY CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-02-23 EP disclosed
CN-114007643-A Chimeric receptors recognizing altered sites of antibodies 中外制药株式会社 2022-02-01 CN disclosed
WO-2020213724-A1 CHIMERIC RECEPTOR RECOGNIZING MODIFICATION SITE OF ANTIBODY 中外製薬株式会社 2020-10-22 WO disclosed
US-10077966-B2 Abrasive entrainment waterjet cutting G.D.O. Inc. (US) 2018-09-18 US disclosed
US-5538641-A Process for recycling laden fluids GLOBAL ENVIRONMENTAL SOLUTIONS, INC. (US) 1996-07-23 US disclosed
WO-1996020904-A1 PROCESS FOR RECYCLING LADEN FLUIDS GLOBAL ENVIRONMENTAL SOLUTIONS, INC. (US) 1996-07-11 WO disclosed
WO-1996021136-A1 HIGH PRESSURE WASHOUT OF EXPLOSIVE AGENTS GETTY HEATHER L (US) 1996-07-11 WO disclosed
EP-0430629-B1 Information recording media MITSUI PETROCHEMICAL IND (JP) 1996-01-10 EP disclosed
US-5167996-A Bonding two transparent resin layers, one of which has recording layer on interior surface MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-12-01 US disclosed
EP-0430629-A2 Information recording media MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-06-05 EP disclosed