SCHEMBL172591

SCHEMBL172591

Cc1cc(Cl)c(Cl)cc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CD44 P16070 1/20 0.45
AHR P35869 3/20 0.41
MAPK1 P28482 2/20 0.41
CYP3A4 P08684 5/20 0.41
CHRM1 P11229 1/20 0.40
ALOX15 P16050 1/20 0.40
MAOA P21397 1/20 0.40
TBXA2R P21731 1/20 0.40
ADRA1A P35348 1/20 0.40
HTR2B P41595 1/20 0.40
FLT1 P17948 1/20 0.39
TSHR P16473 2/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TP53 P04637 1/20 0.37
ALDH1A1 P00352 1/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36

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
SCHEMBL2219302 0.85 CD44 (0.55) CD44MAPK1CYP3A4CHRM1ALOX15
SCHEMBL168826 0.85 CD44 (0.55) CD44AHRMAPK1CYP3A4CHRM1
SCHEMBL120848 0.83 CD44 (0.61) CD44CYP3A4CHRM1ALOX15MAOA
SCHEMBL19785387 0.82 AHR (0.50) CD44AHRMAPK1CYP3A4CHRM1
SCHEMBL811040 0.82 CD44 (0.39) CD44AHRMAPK1CYP3A4CHRM1
Water SCHEMBL29026586 0.80 CD44 (0.58) CD44CYP3A4CHRM1ALOX15MAOA
SCHEMBL811102 0.79 AHR (0.40) CD44AHRMAPK1CYP3A4CHRM1
Calcium Chloride SCHEMBL28286169 0.78 CYP3A4 (0.47) CD44MAPK1CYP3A4CHRM1ALOX15
SCHEMBL24690445 0.77 AHR (0.46) CD44AHRMAPK1CYP3A4CHRM1
SCHEMBL5961689 0.77 CD44 (0.36) CD44CYP3A4CHRM1ALOX15MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11916180-B2 Organic solar cell and photodetector materials and devices THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-02-27 US disclosed
US-11916180-B2 Organic solar cell and photodetector materials and devices THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-02-27 US disclosed
US-20230303495-A9 PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI JEYOU PHARMACEUTICAL CO., LTD. (CN) 2023-09-28 US disclosed
US-20230303495-A9 PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI JEYOU PHARMACEUTICAL CO., LTD. (CN) 2023-09-28 US disclosed
US-20230263056-A1 ORGANIC SOLAR CELL AND PHOTODETECTOR MATERIALS AND DEVICES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-08-17 US disclosed
US-20230263056-A1 ORGANIC SOLAR CELL AND PHOTODETECTOR MATERIALS AND DEVICES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-08-17 US disclosed
US-20230132149-A1 ULTRA NARROW BANDGAP NON-FULLERENE-ACCEPTOR BASED ORGANIC ELECTRONICS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-04-27 US disclosed
EP-3507275-B1 CXCR3 RECEPTOR AGONISTS RECEPTOS LLC (US) 2023-04-26 EP disclosed
US-11586108-B2 Pattern-forming composition, film, infrared cut filter, infrared transmitting filter, solid image pickup element, infrared sensor, and camera module FUJIFILM CORPORATION (JP) 2023-02-21 US disclosed
US-20230026907-A1 PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF ORION CORP (FI) 2023-01-26 US disclosed
US-7309552-B2 Containing the reaction product of a dibenzo [a,c]phenadine-2,7-bisdiazonium salt and a coupler such as N-benzyl-2-hydroxy-7,8-naphthalic acid imide; stilbene charge transport material; 1alkylidene-2,3-diphenylindene acceptor; biphenol; copolycarbonate containing arylamine groups; highly durable RICOH COMPANY, LTD. (JP) 2007-12-18 US disclosed
US-7244847-B2 Benzimidazole compounds ISIS PHARMACEUTICALS, INC. (US) 2007-07-17 US disclosed
US-7175958-B2 Electrophotographic photoconductor, process for forming an image, image forming apparatus and process cartridge for the same RICOH COMPANY, LTD. (JP) 2007-02-13 US disclosed
US-7175958-B2 Electrophotographic photoconductor, process for forming an image, image forming apparatus and process cartridge for the same RICOH COMPANY, LTD. (JP) 2007-02-13 US disclosed
WO-1992022203-A1 SUBSTITUTED PYRIDINE HERBICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-12-23 WO disclosed
US-5114896-A Reaction product of magnesium, halogenated hydrocarbon, alkoxy compound, titanium compound, halogen-containing alcohol and solid halogenated hydrocarbon TONEN CORPORATION (JP) 1992-05-19 US disclosed
EP-0440813-A1 METHOD OF PRODUCING CATALYST COMPONENT FOR OLEFIN POLYMERIZATION Tonen Corporation (JP) 1991-08-14 EP disclosed
EP-0071833-B1 PROCESS FOR PRODUCING 4-BENZOYLPYRAZOLES ISHIHARA SANGYO KAISHA, LTD. (JP) 1987-02-04 EP disclosed
US-4415739-A Process for producing 4-benzoylpyrazoles ISHIHARA SANGYO KAISHA LTD. (JP) 1983-11-15 US disclosed
EP-0071833-A1 Process for producing 4-benzoylpyrazoles ISHIHARA SANGYO KAISHA, LTD. (JP) 1983-02-16 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 (4 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-20230026907-A1 PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF SCN11A, HCN4, CACNA1F CD44 4230/4885AHR 536/4885MAPK1 450/4885
US-20230263056-A1 ORGANIC SOLAR CELL AND PHOTODETECTOR MATERIALS AND DEVICES OCIAD1, OCIAD2, CDH1 CD44 1013/4885AHR 3950/4885MAPK1 2848/4885
US-20230303495-A9 PYRIDINE OXYNITRIDE, PREPARATION METHOD THEREFOR AND USE THEREOF SCN11A, HCN4, CACNA1F CD44 4230/4885AHR 536/4885MAPK1 450/4885
US-11916180-B2 Organic solar cell and photodetector materials and devices OCIAD1, OCIAD2, CDH1 CD44 1013/4885AHR 3950/4885MAPK1 2848/4885

“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.