SCHEMBL1667910

SCHEMBL1667910

COc1ccc(CO)cc1[N+](=O)[O-]

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.66
ALDH1A1 P00352 15/20 0.60
HTT P42858 2/20 0.60
LMNA P02545 2/20 0.60
GAA P10253 1/20 0.60
PKM P14618 1/20 0.54
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
MAPT P10636 1/20 0.52
MAPK1 P28482 1/20 0.52
TDP1 Q9NUW8 1/20 0.51
GFER P55789 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 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
SCHEMBL8867007 0.87 SMN1; SMN2 (0.67) TTRSMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL704754 0.87 TTR (0.64) TTRSMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL29750606 0.87 TTR (0.64) TTRSMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL31090163 0.86 SMN1; SMN2 (0.61) TTRSMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL16233087 0.86 SMN1; SMN2 (0.61) TTRSMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL24749642 0.85 TTR (0.60) TTRSMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL8297975 0.85 ALDH1A1 (0.61) TTRSMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL28712446 0.85 SMN1; SMN2 (0.59) TTRSMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL5913597 0.84 LMNA (0.62) TTRSMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL4977602 0.83 ALDH1A1 (0.60) TTRSMN1; SMN2ALDH1A1HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2486115-B1 ELECTRORHEOLOGIC FLUID COMPRISING ORGANIC SUBSTANCES THAT CAN BE DOPED AND USE THEREOF FRAUNHOFER GES FORSCHUNG (DE) 2015-05-20 EP claimed
US-9939337-B2 Deformation detection sensor and production of the same TOYO TIRE & RUBBER CO., LTD. (JP) 2018-04-10 US disclosed
US-20170288283-A1 SENSOR FOR DETECTING DEFORMATION OF SEALED SECONDARY BATTERY TOYO TIRE & RUBBER CO., LTD. (JP) 2017-10-05 US disclosed
EP-2760838-B1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARM SPA (IT) 2017-05-10 EP disclosed
EP-2760838-B1 DERIVATIVES OF 1-PHENYL-2-PYRIDINYL ALKYL ALCOHOLS AS PHOSPHODIESTERASE INHIBITORS CHIESI FARM SPA (IT) 2017-05-10 EP disclosed
EP-3085572-A1 DEFORMATION DETECTION SENSOR AND PRODUCTION OF THE SAME Toyo Tire & Rubber Co. Ltd. (JP) 2016-10-26 EP disclosed
US-20160305831-A1 DEFORMATION DETECTION SENSOR AND PRODUCTION OF THE SAME TOYO TIRE & RUBBER CO., LTD. (JP) 2016-10-20 US disclosed
US-9265768-B2 Derivatives of 1-phenyl-2-pyridinyl alkyl alcohols as phosphodiesterase inhibitors CHIESI FARMACEUTICI S.P.A. (IT) 2016-02-23 US disclosed
EP-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 EP disclosed
EP-2486115-B1 ELECTRORHEOLOGIC FLUID COMPRISING ORGANIC SUBSTANCES THAT CAN BE DOPED AND USE THEREOF FRAUNHOFER GES FORSCHUNG (DE) 2015-05-20 EP disclosed
CN-1291970-C Method for preparing combretastatins AVENTIS PHARMA SA (FR) 2006-12-27 CN disclosed
US-7049342-B2 Substituted phenylpropionic acid derivatives KYORIN PHARMACEUTICAL CO., LTD. (JP) 2006-05-23 US disclosed
CN-1646476-A Method for preparing combretastatins AVENTIS PHARMA SA (FR) 2005-07-27 CN disclosed
EP-0798292-B1 ANILINE DERIVATIVES HAVING NITROGEN MONOXIDE SYNTHASE INHIBITORY ACTIVITY CHUGAI SEIYAKUKABUSHIKI KAISHA (JP) 2004-11-03 EP disclosed
US-6759555-B2 CONDENSING (3,4,5-TRIMETHOXYBENZYL)TRIPHENYLPHOSPHONIUM BROMIDE WITH 3-NITRO-4-METHOXYBENZALDEHYDE, REDUCING THE NITRO INTERMEDIATE TO FORM 2-METHOXY-5-(2-(3,4,5-TRIMETHOXYPHENYL)-ETHENYL)ANILINE AVENTIS PHARMA S.A. (FR) 2004-07-06 US disclosed
US-20030220404-A1 Process for the preparation of combretastatins AVENTIS PHARMA S.A. (FR) 2003-11-27 US disclosed
US-20030187068-A1 Substituted phenylpropionic acid derivatives KYORIN PHARMACEUTICAL CO., LTD. (JP) 2003-10-02 US disclosed
US-6534546-B1 Guanidine- or isothioureido-N-derived anilines; brain, nervous system, and neurodegenerative disorders CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-18 US disclosed
EP-1285908-A1 SUBSTITUTED PHENYLPROPIONIC ACID DERIVATIVES KYORIN PHARMACEUTICAL CO., LTD. (JP) 2003-02-26 EP disclosed
EP-0798292-A1 ANILINE DERIVATIVES HAVING NITROGEN MONOXIDE SYNTHASE INHIBITORY ACTIVITY Chugai Seiyaku Kabushiki Kaisha (JP) 1997-10-01 EP 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 (2 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-20030187068-A1 Substituted phenylpropionic acid derivatives PPARA, PPARG, PPARD TTR 2531/4885SMN1; SMN2 4657/4885ALDH1A1 429/4885
US-20030220404-A1 Process for the preparation of combretastatins TGFB2, HMGCR, TGFB1 TTR 794/4885SMN1; SMN2 1402/4885ALDH1A1 2753/4885

“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.