SCHEMBL52022

SCHEMBL52022

O=[N+]([O-])[O-].c1ccc([I+]c2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
LMNA P02545 2/20 0.48
FBP1 P09467 4/20 0.39
TDP1 Q9NUW8 2/20 0.38
KCNA4 P22459 1/20 0.37
KCNA1 Q09470 1/20 0.37
KCNAB1 Q14722 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CRHBP P24387 2/20 0.37
CRHR2 Q13324 2/20 0.37
ATM Q13315 1/20 0.37
TLR9 Q9NR96 1/20 0.37
HPGD P15428 1/20 0.37
ALOX12 P18054 1/20 0.37
HSD17B10 Q99714 1/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
PTPRF P10586 1/20 0.35

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
SCHEMBL31145688 0.87 ALDH1A1 (0.60) ALDH1A1LMNATDP1L3MBTL1MEN1
SCHEMBL426370 0.84 ALDH1A1 (0.62) ALDH1A1LMNATDP1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL31093480 0.82 ALDH1A1 (0.60) ALDH1A1LMNATDP1L3MBTL1MEN1
SCHEMBL36560 0.82 ALDH1A1 (0.40) ALDH1A1LMNATDP1ALOX12HSD17B10
SCHEMBL6921249 0.82 CA4 (0.46) ALDH1A1FBP1MEN1KMT2AHPGD
SCHEMBL30561568 0.79 CYP3A4 (0.35) ALDH1A1LMNATDP1ALOX12HSD17B10
SCHEMBL425911 0.79 TSHR (0.59) ALDH1A1LMNATDP1MEN1KMT2A
Fluoride Ion SCHEMBL25292299 0.78 ALDH1A1 (0.39) ALDH1A1LMNATDP1ALOX12HSD17B10
SCHEMBL12762155 0.78 ALDH1A1 (0.38) ALDH1A1LMNATDP1ALOX12HSD17B10
Fluoride Ion SCHEMBL216895 0.78 ALDH1A1 (0.39) ALDH1A1LMNATDP1ALOX12HSD17B10

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 1225 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4749726-A1 FUEL CELL COOLANT OVER-PRESSURIZATION SYSTEM Honeywell International Inc. (US) 2026-05-27 EP claimed
US-20260128331-A1 FUEL CELL COOLANT OVER-PRESSURIZATION SYSTEM HONEYWELL INT INC (US) 2026-05-07 US claimed
WO-2025106936-A1 POLY(METH)ACRYLIMIDE MATERIALS WITH ENHANCED THERMOMECHANICAL PROPERTIES GENCORES, INC. (US) 2025-05-22 WO claimed
CN-118607122-B System-level three-dimensional simulation supercharging intercooling equivalent simplifying method for diesel engine 北京理工大学 2025-05-09 CN claimed
US-12286841-B2 Dimensioning of a threaded axial gap VALLOUREC OIL AND GAS FRANCE (FR) 2025-04-29 US claimed
CN-119509724-A Turbine front temperature prediction method in high temperature state 中国航发沈阳发动机研究所 2025-02-25 CN claimed
US-12232338-B2 Low-voltage operation dual-gate organic thin-film transistors and methods of manufacturing thereof CORNING INCORPORATED (US) 2025-02-18 US claimed
CN-110783787-B Circuit switching device of domestic chip 广州邦讯信息系统有限公司 2025-02-14 CN claimed
EP-4501550-A1 RIGIDIZABLE INSERTION TOOL General Electric Company (US) 2025-02-05 EP claimed
CN-222419266-U Ultraviolet intensity detector convenient for wireless data acquisition 爱迪特(秦皇岛)科技股份有限公司 2025-01-28 CN claimed
WO-2015087020-A1 PHOTOPOLYMERIZABLE LIQUID COMPOSITION LABORATOIRES URGO (FR) 2015-06-18 WO claimed
US-20150152328-A1 PHOTOACTIVATED ETCHING PASTE AND ITS USE MERCK PATENT GMBH (DE) 2015-06-04 US claimed
EP-2856519-A1 PHOTOACTIVATED ETCHING PASTE AND ITS USE Merck Patent GmbH (DE) 2015-04-08 EP claimed
EP-2760569-A2 GRAFTED MEMBRANES AND SUBSTRATES HAVING SURFACES WITH SWITCHABLE SUPEROLEOPHILICITY AND SUPEROLEOPHOBICITY AND APPLICATIONS THEREOF King Abdullah University Of Science And Technology (SA) 2014-08-06 EP claimed
WO-2013182265-A1 PHOTOACTIVATED ETCHING PASTE AND ITS USE MERCK PATENT GMBH (DE) 2013-12-12 WO claimed
US-20130264287-A1 GRAFTED MEMBRANES AND SUBSTRATES HAVING SURFACES WITH SWITCHABLE SUPEROLEOPHILICITY AND SUPEROLEOPHOBICITY AND APPLICATIONS THEREOF KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2013-10-10 US claimed
WO-2013046056-A2 GRAFTED MEMBRANES AND SUBSTRATES HAVING SURFACES WITH SWITCHABLE SUPEROLEOPHILICITY AND SUPEROLEOPHOBICITY AND APPLICATIONS THEREOF KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2013-04-04 WO claimed
US-7851115-B2 Iodonium hole blocking layer photoconductors XEROX CORPORATION (US) 2010-12-14 US claimed
US-20090035676-A1 IODONIUM HOLE BLOCKING LAYER PHOTOCONDUCTORS XEROX CORPORATION (US) 2009-02-05 US claimed
US-20080176678-A1 Compositions for Use in Golf Balls ACUSHNET COMPANY 2008-07-24 US claimed

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-20260128331-A1 FUEL CELL COOLANT OVER-PRESSURIZATION SYSTEM TMCO1, FH, SLC9A2 ALDH1A1 1808/4885LMNA 3726/4885FBP1 2273/4885

“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.