SCHEMBL182941

SCHEMBL182941

COc1ccc(O)c([N+](=O)[O-])c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.56
ALDH1A1 P00352 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
HPGD P15428 2/20 0.56
TP53 P04637 1/20 0.56
TSHR P16473 1/20 0.56
GPR35 Q9HC97 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.55
ALOX15 P16050 1/20 0.55
HSD17B10 Q99714 1/20 0.55
ABCB1 P08183 1/20 0.52
ABCC1 P33527 1/20 0.52
ALDH5A1 P51649 1/20 0.51
ABAT P80404 1/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
MAPT P10636 5/20 0.51
KDM4E B2RXH2 3/20 0.51

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
SCHEMBL6988294 0.88 ABCB1 (0.47) MAPK1ALDH1A1SMN1; SMN2HPGDTP53
Trifluoromethanesulfonic Acid SCHEMBL7493539 0.87 CA12 (0.48) MAPK1ALDH1A1SMN1; SMN2HPGDTP53
SCHEMBL9722263 0.86 MAPT (0.51) MAPK1ALDH1A1SMN1; SMN2HPGDTP53
SCHEMBL1852678 0.85 GPR35 (0.56) MAPK1ALDH1A1SMN1; SMN2HPGDGPR35
SCHEMBL1581489 0.85 GPR35 (0.60) MAPK1ALDH1A1SMN1; SMN2HPGDTP53
SCHEMBL8225900 0.83 ERN1 (0.50) MAPK1ALDH1A1SMN1; SMN2HPGDTP53
SCHEMBL1662886 0.82 ALDH1A1 (0.65) MAPK1ALDH1A1SMN1; SMN2TSHRMAPT
SCHEMBL7010553 0.82 ALDH1A1 (0.49) MAPK1ALDH1A1SMN1; SMN2HPGDTP53
SCHEMBL11258868 0.81 ALDH1A1 (0.55) MAPK1ALDH1A1SMN1; SMN2HPGDMAPT
SCHEMBL10340370 0.81 ALDH1A1 (0.61) MAPK1ALDH1A1SMN1; SMN2MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119684169-A Synthesis method of Iguratimod intermediate impurity and application of impurity 常州佳德医药科技有限公司 2025-03-25 CN claimed
EP-4483376-A1 MEASUREMENT, DIAGNOSIS, TREATMENT AND MANAGEMENT OF METABOLIC SYNDROME García Sada, Fernando (MX) 2025-01-01 EP claimed
CN-118922890-A Measurement, diagnosis, treatment and management of metabolic syndrome 费尔南多·加西亚·萨达 2024-11-08 CN claimed
WO-2023161832-A1 MEASUREMENT, DIAGNOSIS, TREATMENT AND MANAGEMENT OF METABOLIC SYNDROME GARCIA SADA FERNANDO (MX) 2023-08-31 WO claimed
US-20230266340-A1 Measurement, Diagnosis, Treatment and Management of Metabolic Syndrome SILTI AG (CH) 2023-08-24 US claimed
US-7067024-B2 Reduced sensitivity, melt-pourable TNT replacements ALLIANT TECHSYSTEMS INC. (US) 2006-06-27 US claimed
EP-1575575-A2 SAFE CHEMICAL UNCOUPLERS FOR THE TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2005-09-21 EP claimed
US-20040138301-A1 Chemical uncouplers for the treatment of obesity HIGH POINT PHARMACEUTICALS, LLC 2004-07-15 US claimed
WO-2004041256-A2 SAFE CHEMICAL UNCOUPLERS FOR THE TREATMENT OF OBESITY NOVO NORDISK A/S (DK) 2004-05-21 WO claimed
EP-1399400-A1 REDUCED SENSITIVITY, MELT-POURABLE TNT REPLACEMENTS ALLIANT TECHSYSTEMS INC. (US) 2004-03-24 EP claimed
EP-1399399-A1 REDUCED SENSITIVITY, MELT-POURABLE TRITONAL REPLACEMENTS ALLIANT TECHSYSTEMS INC. (US) 2004-03-24 EP claimed
US-6648998-B2 Mixture; replacement of trinitrotoluene with (mono or di)nitro aromatic compounds ALLIANT TECHSYSTEMS INC. 2003-11-18 US claimed
US-20030140993-A1 Reduced sensitivity, melt-pourable tritonal replacements NORTHROP GRUMMAN SYSTEMS CORPORATION 2003-07-31 US claimed
WO-2003002486-A1 REDUCED SENSITIVITY, MELT-POURABLE TNT REPLACEMENTS ALLIANT TECHSYSTEMS INC. (US) 2003-01-09 WO claimed
WO-2003002485-A1 REDUCED SENSITIVITY, MELT-POURABLE TRITONAL REPLACEMENTS ALLIANT TECHSYSTEMS INC. (US) 2003-01-09 WO claimed
US-20030005988-A1 Reduced sensitivity, melt-pourable TNT replacements NORTHROP GRUMMAN SYSTEMS CORPORATION 2003-01-09 US claimed
US-20020038682-A1 Reduced sensitivity melt-cast explosives Northrop Grumman Innovation Systems, Inc. 2002-04-04 US claimed
WO-2001046091-A1 REDUCED SENSITIVITY MELT-CAST EXPLOSIVES DOLL, DANIEL, W. 2001-06-28 WO claimed
JP-59128394-A None JP disclosed
US-3947434-A 9-(P-phenylazoanilino)-7-methyl-1H-imidazo[4,5-f]quinolines MORTON-NORWICH PRODUCTS, INC. (US) 1976-03-30 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 (1 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-20040138301-A1 Chemical uncouplers for the treatment of obesity PC, CPT2, IDH2 MAPK1 2044/4885ALDH1A1 2021/4885SMN1; SMN2 1920/4885

“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.