SCHEMBL254524

SCHEMBL254524

CC(C)c1ccc(Cl)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.50
SLC6A4 P31645 4/20 0.48
SLC6A2 P23975 3/20 0.48
SLC6A3 Q01959 2/20 0.48
LMNA P02545 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TP53 P04637 1/20 0.43
PNMT P11086 1/20 0.43
PTGS1 P23219 2/20 0.43
TRPA1 O75762 1/20 0.43
CACNA1C Q13936 1/20 0.43
IDO1 P14902 1/20 0.42
TDO2 P48775 1/20 0.42
IDO2 Q6ZQW0 1/20 0.42
CYP1B1 Q16678 1/20 0.42
GAA P10253 1/20 0.41
ALOX12 P18054 1/20 0.41
HIF1A Q16665 1/20 0.41

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
Hydrogen Peroxide SCHEMBL10347735 0.95 ALDH1A1 (0.49) AHRSLC6A4SLC6A2SLC6A3LMNA
SCHEMBL14670465 0.85 AHR (0.67) AHRSLC6A4SLC6A2SLC6A3CYP1B1
SCHEMBL5367586 0.84 IDO1 (0.45) SLC6A4SLC6A2SLC6A3LMNAALDH1A1
SCHEMBL10867874 0.82 AHR (0.48) AHRSLC6A4SLC6A2SLC6A3LMNA
SCHEMBL13524616 0.81 AHR (0.54) AHRALDH1A1HTTSMN1; SMN2TP53
SCHEMBL4458063 0.80 AHR (0.46) AHRSLC6A4SLC6A2SLC6A3LMNA
SCHEMBL17084188 0.80 AHR (0.46) AHRSLC6A4SLC6A2SLC6A3LMNA
SCHEMBL22964332 0.80 AHR (0.46) AHRSLC6A4SLC6A2SLC6A3LMNA
SCHEMBL22032277 0.80 AHR (0.46) AHRSLC6A4SLC6A2SLC6A3LMNA
SCHEMBL2951028 0.80 AHR (0.46) AHRSLC6A4SLC6A2SLC6A3LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0121192-B1 ANALYTICAL TEST COMPOSITION, DEVICE, METHOD FOR ITS PREPARATION AND METHOD FOR THE DETERMINATION OF PEROXIDATIVELY ACTIVE SUBSTANCE MILES INC. (US) 1990-06-27 EP claimed
US-12043613-B2 Inhibitors of SARM1 DISARM THERAPEUTICS, INC. (US) 2024-07-23 US disclosed
US-12043621-B2 Small molecule inhibitors of Interleukin-4 TRUSTEES OF BOSTON UNIVERSITY (US) 2024-07-23 US disclosed
US-12043613-B2 Inhibitors of SARM1 DISARM THERAPEUTICS, INC. (US) 2024-07-23 US disclosed
US-12043621-B2 Small molecule inhibitors of Interleukin-4 TRUSTEES OF BOSTON UNIVERSITY (US) 2024-07-23 US disclosed
US-20240239772-A1 PROTEASE INHIBITORS AND METHODS OF USE THE CLEVELAND CLINIC FOUNDATION 2024-07-18 US disclosed
US-20240239772-A1 PROTEASE INHIBITORS AND METHODS OF USE THE CLEVELAND CLINIC FOUNDATION 2024-07-18 US disclosed
US-20240228495-A1 Tricyclic Inhibitors of Influenza Virus Endonuclease STANFORD RES INST INT (US) 2024-07-11 US disclosed
US-20240228495-A1 Tricyclic Inhibitors of Influenza Virus Endonuclease STANFORD RES INST INT (US) 2024-07-11 US disclosed
EP-3863638-B1 PHOSPHODIESTERASE INHIBITORS UNIV NEBRASKA (US) 2024-06-26 EP disclosed
WO-2003101382-A2 COMPOUNDS USEFUL IN THE TREATMENT OF ANTHRAX AND INHIBITING LETHAL FACTOR MERCK & CO., INC. (US) 2003-12-11 WO disclosed
EP-0625507-B1 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO (JP) 1997-07-23 EP disclosed
US-5621010-A ANTIHYPERCHOLESTEROLEMIA AND ANTIATHEROSCLEROSIS NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-04-15 US disclosed
EP-0625507-A2 Urea derivatives and their use as acat inhibitors NISSHIN FLOUR MILLING CO., LTD. (JP) 1994-11-23 EP disclosed
EP-0121192-B1 ANALYTICAL TEST COMPOSITION, DEVICE, METHOD FOR ITS PREPARATION AND METHOD FOR THE DETERMINATION OF PEROXIDATIVELY ACTIVE SUBSTANCE MILES INC. (US) 1990-06-27 EP disclosed
US-4568777-A GAS PHASE REACTION WITH PENTASIL, MORDENITE AND FAUJASITE ZEOLITE HOECHST AKTIENGESELLSCHAFT (DE) 1986-02-04 US disclosed
EP-0121192-A2 Analytical test composition, device, method for its preparation and method for the determination of peroxidatively active substance MILES INC. (US) 1984-10-10 EP disclosed
US-4447542-A USING SUBSTITUTED CUMENE HYDROPEROXIDE AND INDICATOR; COLORIMETRIC ANALYSIS MILES LABORATORIES, INC. (US) 1984-05-08 US disclosed
US-4005218-A Antiparasitic salicylanilide derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1977-01-25 US disclosed
US-3954876-A HALOCUMENE OXIDATION CATALYZED BY METAL PHTHALOCYANINE COMPLEX YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 1976-05-04 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 (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-20240228495-A1 Tricyclic Inhibitors of Influenza Virus Endonuclease RNASEH1, RNASEL, DNASE1 AHR 1150/4885SLC6A4 3108/4885SLC6A2 3980/4885
US-12043613-B2 Inhibitors of SARM1 SARM1, SMN1; SMN2, SARNP AHR 4440/4885SLC6A4 3410/4885SLC6A2 2958/4885
US-12043621-B2 Small molecule inhibitors of Interleukin-4 IL4, IL2, IL4I1 AHR 2128/4885SLC6A4 2751/4885SLC6A2 4855/4885
US-20240239772-A1 PROTEASE INHIBITORS AND METHODS OF USE ACE2, ACE, TMPRSS2 AHR 2847/4885SLC6A4 4659/4885SLC6A2 4837/4885

“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.