SCHEMBL403698

SCHEMBL403698

COc1ccc(-c2ccccc2)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.55
ADORA1 P30542 1/20 0.55
PTGS2 P35354 3/20 0.54
PTGS1 P23219 1/20 0.53
ESR2 Q92731 1/20 0.52
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ACLY P53396 4/20 0.49
HDAC8 Q9BY41 1/20 0.48
MAPT P10636 3/20 0.48
ALDH1A1 P00352 3/20 0.48
TP53 P04637 1/20 0.48
LMNA P02545 1/20 0.48
KMO O15229 1/20 0.48
KDM4E B2RXH2 1/20 0.47
HPGD P15428 1/20 0.47
ALOX15 P16050 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL29375895 1.00 ADORA2A (0.55) ADORA2AADORA1PTGS2PTGS1ESR2
SCHEMBL12326172 0.89 PTGS2 (0.53) ADORA2AADORA1PTGS2PTGS1KMT2A
SCHEMBL9617394 0.86 CYP17A1 (0.49) ADORA2AADORA1PTGS2PTGS1KMT2A
Chloroneb SCHEMBL4292226 0.85 MAPK10 (0.51) ADORA2AADORA1KMT2AMEN1L3MBTL1
SCHEMBL457121 0.84 DYRK1A (0.56) ESR2KMT2AMEN1L3MBTL1ACLY
SCHEMBL12603887 0.84 TAS1R3 (0.49) PTGS2PTGS1ESR2ACLYALDH1A1
SCHEMBL13906293 0.84 ACHE (0.54) PTGS2PTGS1KMT2AMEN1L3MBTL1
SCHEMBL23909988 0.82 ALDH1A1 (0.48) ADORA2AADORA1PTGS2PTGS1KMT2A
SCHEMBL13906296 0.82 PTGS2 (0.50) PTGS2PTGS1KMT2AACLYKMO
SCHEMBL21116012 0.82 ADORA2A (0.50) ADORA2AADORA1PTGS2PTGS1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117623947-B Synthesis method of bifenazate intermediate 绍兴上虞新银邦生化有限公司 2026-05-12 CN disclosed
US-12227485-B2 Compounds useful for the treatment of infection with Mannheimia haemolytica or Histophilus somni INTERVET INC. (US) 2025-02-18 US disclosed
US-12157717-B2 Compounds for the treatment of bovine or swine respiratory disease INTERVET INC. (US) 2024-12-03 US disclosed
CN-117623947-A Synthesis method of bifenazate intermediate 绍兴上虞新银邦生化有限公司 2024-03-01 CN disclosed
CN-116813507-A Synthesis method of 5-substituent-2-alkoxy phenyl hydrazino formate compound 绍兴上虞新银邦生化有限公司 2023-09-29 CN disclosed
CN-110300578-B Compounds for the treatment of respiratory diseases in cattle or pigs 英特维特国际股份有限公司 2022-12-13 CN disclosed
US-11406617-B2 Compounds for the treatment of bovine or swine respiratory disease INTERVET INC. (US) 2022-08-09 US disclosed
US-20220202786-A1 METHODS FOR TREATMENT OF CANCER MINERVA BIOTECHNOLOGIES CORPORATION (US) 2022-06-30 US disclosed
US-20220169581-A1 DIRECT AROMATIC CARBON-OXYGEN AND CARBON-HYDROGEN BOND FUNCTIONALIZATION VIA ORGANIC PHOTOREDOX CATALYST THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2022-06-02 US disclosed
US-11202775-B2 Methods for treatment of cancer MINERVA BIOTECHNOLOGIES CORPORATION (US) 2021-12-21 US disclosed
WO-2004048365-A1 2,4,6-TRISUBSTITUTED PYRIMIDINES AS PHOSPHOTIDYLINOSITOL (PI) 3-KINASE INHIBITORS AND THEIR USE IN THE TREATMENT OF CANCER CHIRON CORPORATION (US) 2004-06-10 WO disclosed
US-20040087626-A1 Substituted benz-azoles and methods of their use as inhibitors of Raf kinase NOVARTIS AG (CH) 2004-05-06 US disclosed
WO-2003082272-A1 SUBSTITUTED BENZAZOLES AND USE THEREOF AS RAF KINASE INHIBITORS CHIRON CORPORATION (US) 2003-10-09 WO disclosed
CN-1208403-A Compounds BRITISH ASTRA PHARMACEUTICALS (GB) 1999-02-17 CN disclosed
US-4431660-A UROGENITAL DISORDERS; ENZYME INHIBITORS; KIDNEY AND BLADDER STONES MERCK & CO., INC. (US) 1984-02-14 US disclosed
EP-0021228-B1 4-SUBSTITUTED-3-HYDROXY-3-PYRROLINE-2,5-DIONE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME MERCK & CO. INC. (US) 1982-09-01 EP disclosed
US-4256758-A 4-Substituted-3-hydroxy-3-pyrroline-2,5-dione inhibitors of glycolic acid oxidase MERCK & CO., INC. (US) 1981-03-17 US disclosed
EP-0021228-A1 4-Substituted-3-hydroxy-3-pyrroline-2,5-dione compounds, process for their preparation and pharmaceutical compositions containing the same MERCK & CO. INC. (US) 1981-01-07 EP disclosed
US-4216109-A BROAD TEMPERATURE AND CHEMICAL STABILITY; TIMEPIECES CITIZEN WATCH CO., LTD. (JP) 1980-08-05 US disclosed
US-4138359-A CHLOROBIPHENYL BENZOATES, BROAD RANGE OF TEMPERATURE STABILITY, CHEMICAL RESISTANCE CITIZEN WATCH CO., LTD. (JP) 1979-02-06 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 (7 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-20040087626-A1 Substituted benz-azoles and methods of their use as inhibitors of Raf kinase BRAF, RAF1, ARAF ADORA2A 4336/4885ADORA1 4219/4885PTGS2 3583/4885
US-20220169581-A1 DIRECT AROMATIC CARBON-OXYGEN AND CARBON-HYDROGEN BOND FUNCTIONALIZATION VIA ORGANIC PHOTOREDOX CATALYST PPOX, CYCS, SCO2 ADORA2A 950/4885ADORA1 1400/4885PTGS2 3377/4885
US-11202775-B2 Methods for treatment of cancer TP53, TOP2B, BRCA1 ADORA2A 2488/4885ADORA1 4177/4885PTGS2 2087/4885
US-12227485-B2 Compounds useful for the treatment of infection with Mannheimia haemolytica or Histophilus somni SORD, HEXD, SNRPD1 ADORA2A 3040/4885ADORA1 3084/4885PTGS2 1037/4885
US-11406617-B2 Compounds for the treatment of bovine or swine respiratory disease PIGS, BTD, PPARD ADORA2A 1027/4885ADORA1 907/4885PTGS2 1409/4885
US-12157717-B2 Compounds for the treatment of bovine or swine respiratory disease PIGS, BTD, PPARD ADORA2A 1026/4885ADORA1 590/4885PTGS2 927/4885
US-20220202786-A1 METHODS FOR TREATMENT OF CANCER TP53, TOP2B, BRCA1 ADORA2A 2488/4885ADORA1 4177/4885PTGS2 2087/4885

“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.