SCHEMBL916699

SCHEMBL916699

O=[N+]([O-])c1ccc(CP(=O)(O)O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.61
TSHR P16473 1/20 0.55
LOXL2 Q9Y4K0 1/20 0.53
CA1 P00915 2/20 0.52
CYP2C19 P33261 2/20 0.52
CA2 P00918 2/20 0.52
ALDH1A1 P00352 1/20 0.52
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
CA12 O43570 2/20 0.51
MMP2 P08253 2/20 0.51
MMP9 P14780 1/20 0.51
MMP8 P22894 1/20 0.51
MMP14 P50281 1/20 0.51
CYP1A2 P05177 1/20 0.49
IDO1 P14902 3/20 0.48
PGK1 P00558 2/20 0.48
PGK2 P07205 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
Benzylphosphonic Acid SCHEMBL27466353 0.93 CYP1A2 (0.60) AKR1C3TSHRLOXL2CYP2C19ALDH1A1
Diethylamine SCHEMBL28801129 0.88 AKR1C3 (0.50) AKR1C3TSHRLOXL2CA1CYP2C19
SCHEMBL11040755 0.88 AKR1C3 (0.61) AKR1C3TSHRLOXL2CA1CYP2C19
SCHEMBL8648393 0.86 AKR1C3 (0.59) AKR1C3TSHRLOXL2CA1CYP2C19
SCHEMBL21815480 0.85 AKR1C3 (0.57) AKR1C3TSHRLOXL2CA1CYP2C19
SCHEMBL2421099 0.81 TSHR (0.61) AKR1C3TSHRLOXL2CA1CYP2C19
SCHEMBL28073350 0.80 AKR1C3 (0.57) AKR1C3TSHRLOXL2CA1CYP2C19
Phosphoric Acid SCHEMBL28639141 0.80 CA1 (0.65) AKR1C3TSHRCA1CA2ALDH1A1
SCHEMBL2034978 0.80 LOXL2 (0.53) AKR1C3TSHRLOXL2CA1CYP2C19
SCHEMBL2030737 0.80 LOXL2 (0.53) AKR1C3TSHRLOXL2CYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2949781-B1 RINSABLE METAL PRETREATMENT METHODS AND COMPOSITIONS CHEMETALL CORP (US) 2017-11-22 EP claimed
CN-105524492-A Simple low-cost magnetic fine particle surface active group introduction method UNIV SICHUAN 2016-04-27 CN claimed
EP-2949781-A1 RINSABLE METAL PRETREATMENT METHODS AND COMPOSITIONS Chemetall Corp. (US) 2015-12-02 EP claimed
CN-104195537-A Rinsable metal pretreatment methods and compositions CHEMETALL GMBH 2014-12-10 CN claimed
US-8585834-B2 Rinsable metal pretreatment methods and compositions CHEMETALL CORPORATION 2013-11-19 US claimed
US-7732534-B2 Polymers functionalized with nitro compounds BRIDGESTONE CORPORATION (JP) 2010-06-08 US claimed
US-20080245444-A1 Rinsable metal pretreatment methods and compositions GENERAL ELECTRIC COMPANY (US) 2008-10-09 US claimed
US-20080131709-A1 COMPOSITE STRUCTURE WITH ORGANOPHOSPHONATE ADHERENT LAYER AND METHOD OF PREPARING ACULON INC. (US) 2008-06-05 US claimed
CN-101137767-A Rinsable metal pretreatment method and composition GEN ELECTRIC (US) 2008-03-05 CN claimed
US-20080051552-A1 Polymers functionalized with nitro compounds BRIDGESTONE CORPORATION 2008-02-28 US claimed
US-20080051519-A1 Polymers functionalized with nitro compounds BRIDGESTONE CORPORATION (JP) 2008-02-28 US claimed
EP-1841898-A1 RINSABLE METAL PRETREATMENT METHODS AND COMPOSITIONS General Electric Company (US) 2007-10-10 EP claimed
WO-2006076197-A1 RINSABLE METAL PRETREATMENT METHODS AND COMPOSITIONS GENERAL ELECTRIC COMPANY (US) 2006-07-20 WO claimed
US-20060151070-A1 Rinsable metal pretreatment methods and compositions GENERAL ELECTRIC COMPANY (US) 2006-07-13 US claimed
CN-1170151-A Surface modification of magnetic particle pigments MINNESOTA MINING & MFG (US) 1998-01-14 CN claimed
EP-3657916-B1 STRUCTURE INCLUDING ELECTROCONDUCTIVE PATTERN REGIONS, METHOD FOR PRODUCING SAME, LAMINATE, METHOD FOR PRODUCING SAME, AND COPPER WIRING ASAHI CHEMICAL IND (JP) 2026-04-29 EP disclosed
US-20260014284-A1 PROCESS FOR PREPARATION OF RADIOLABELED STYRYLPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF JUBILANT DRAXIMAGE INC (CA) 2026-01-15 US disclosed
US-4568623-A HIGHER PHOTOSENSITIVITY AND DURABILITY FUJI PHOTO FILM CO., LTD. (JP) 1986-02-04 US disclosed
EP-0131140-A2 Photoconductive compositions and electrophotographic photoreceptors using the same FUJI PHOTO FILM CO., LTD. (JP) 1985-01-16 EP disclosed
EP-0123300-A2 Complexing of biologically active or functional compounds and methods of preparing and utilizing same ENZO BIOCHEM, INC. (US) 1984-10-31 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 (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-20260014284-A1 PROCESS FOR PREPARATION OF RADIOLABELED STYRYLPYRIDINES AND PHARMACEUTICAL COMPOSITIONS THEREOF NEFM, APP, PSEN2 AKR1C3 962/4885TSHR 415/4885LOXL2 4736/4885

“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.