SCHEMBL7962088

SCHEMBL7962088

O=Cc1cc(O)c(O)c(I)c1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.50
ERN1 O75460 2/20 0.47
KDM4E B2RXH2 1/20 0.46
PTGS2 P35354 1/20 0.46
RAB9A P51151 1/20 0.46
TTR P02766 1/20 0.39
ALDH1A1 P00352 1/20 0.38
AOX1 Q06278 1/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
NAT1 P18440 1/20 0.36
ALDH5A1 P51649 1/20 0.36
ABAT P80404 1/20 0.36
APP P05067 1/20 0.35
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL1005116 0.88 ERN1 (0.52) XDHERN1KDM4EPTGS2RAB9A
SCHEMBL132439 0.83 XDH (0.59) XDHKDM4EPTGS2RAB9AALDH1A1
SCHEMBL27935044 0.83 XDH (0.59) XDHKDM4EPTGS2RAB9AALDH1A1
SCHEMBL24981909 0.83 ERN1 (0.44) XDHERN1KDM4EPTGS2RAB9A
Water SCHEMBL36578 0.80 XDH (0.57) XDHKDM4EPTGS2RAB9AALDH1A1
SCHEMBL31122716 0.80 XDH (0.57) XDHKDM4EPTGS2RAB9AALDH1A1
SCHEMBL6740604 0.80 ERN1 (0.45) ERN1PTGS2TTRNAT1APP
SCHEMBL28702107 0.78 CHEK1 (0.46) XDHERN1TTR
SCHEMBL27426693 0.78 KDM4E (0.52) XDHERN1KDM4EPTGS2RAB9A
SCHEMBL22991515 0.77 TTR (0.39) ERN1KDM4ETTRALDH1A1NAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0488860-B1 Method for the production of polyalkoxylated aromatic compounds RHONE POULENC CHIMIE (FR) 1995-10-11 EP claimed
EP-0423010-B1 METHOD FOR THE PRODUCTION OF ALKOXYBENZALDEHYDES RHONE-POULENC CHIMIE (FR) 1993-09-29 EP claimed
WO-2024135708-A1 METHOD FOR PRODUCING COMPOUND, POLYMER, COMPOSITION, AND PATTERN FORMATION METHOD 三菱瓦斯化学株式会社 2024-06-27 WO disclosed
EP-2486026-B1 DERIVATIVES OF DI(PHENYLPROPANOID) GLYCEROL FOR THE TREATMENT OF CANCER MACGREGOR ALEXANDER (CA) 2020-06-24 EP disclosed
EP-3101014-B1 NOVEL 2-PHENYLBENZOFURAN DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PRODUCTION METHOD FOR SAME AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING INFLAMMATORY DISEASE COMPRISING SAME AS ACTIVE INGREDIENT KOREA RES INST BIOSCIENCE & BIOTECHNOLOGY (KR) 2019-03-13 EP disclosed
US-10053443-B2 2-phenylbenzofuran derivatives, method for preparing the same and use of the same for treating inflammatory disease KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2018-08-21 US disclosed
US-20170174645-A1 2-phenylbenzofuran derivatives, method for preparing the same and use of the same for treating inflammatory disease KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2017-06-22 US disclosed
EP-3101014-A1 NOVEL 2-PHENYLBENZOFURAN DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PRODUCTION METHOD FOR SAME AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING INFLAMMATORY DISEASE COMPRISING SAME AS ACTIVE INGREDIENT Korea Research Institute of Bioscience and Biotechnology (KR) 2016-12-07 EP disclosed
US-20160332980-A1 NOVEL 2-PHENYLBENZOFURAN DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PRODUCTION METHOD FOR SAME AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING INFLAMMATORY DISEASE COMPRISING SAME AS ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2016-11-17 US disclosed
US-8895032-B2 Dendritic nano-antioxidants CENTRAL MICHIGAN UNIVERSITY (US) 2014-11-25 US disclosed
US-6313305-B1 ANTIBIOTICS, BACTERICIDES HOECHST MARION ROUSSEL (FR) 2001-11-06 US disclosed
US-5883248-A QUATERNARY AMMONIUM INTERMEDIATES ROUSSEL UCLAF (FR) 1999-03-16 US disclosed
US-5763617-A Cephalosporins ROUSSEL UCLAF (FR) 1998-06-09 US disclosed
CN-1178671-A Method for preparing novel cephalosporin medicine composition containing substituted benzyloxy imino on the 7 th position ROUSSEL UCLAF CO (FR) 1998-04-15 CN disclosed
US-5728828-A A 3-(3-CHLORO- OR IODOPROP-1-EN-1-YL),7-(2-AMINOTHIAZOL-4-YL) ((CARBOXY)(PHENYL)METHOXYIMINO)ACETAMIDO-3-CEPHEM; GRAMNEGATIVE AND -POSITIVE BACTERIA, ESP. ANTIBIOTIC-RESISTANCE STAPHYLOCOCCUS ROUSSEL UCLAF (FR) 1998-03-17 US disclosed
US-5712266-A Cephalosporins ROUSSEL UCLAF (FR) 1998-01-27 US disclosed
US-5587372-A BACERICIDES ROUSSEL UCLAF (FR) 1996-12-24 US disclosed
US-5455238-A Bactericides ROUSSEL UCLAF (FR) 1995-10-03 US disclosed
EP-0551034-A2 Cephalosporins having in position 7 a benzyloxyimino radical substitute, process for their preparation and their use as medicaments ROUSSEL UCLAF (FR) 1993-07-14 EP disclosed
CN-1073177-A Novel cephalosporins containing a substituted benzyloxyimino radical in position 7, process for their preparation and their use as medicaments ROUSSEL UCLAF (FR) 1993-06-16 CN 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 (3 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-10053443-B2 2-phenylbenzofuran derivatives, method for preparing the same and use of the same for treating inflammatory disease TNF, IL6, LITAF XDH 386/4885ERN1 3995/4885KDM4E 1260/4885
US-20170174645-A1 2-phenylbenzofuran derivatives, method for preparing the same and use of the same for treating inflammatory disease TNF, IL6, LITAF XDH 386/4885ERN1 3995/4885KDM4E 1260/4885
US-20160332980-A1 NOVEL 2-PHENYLBENZOFURAN DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PRODUCTION METHOD FOR SAME AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING INFLAMMATORY DISEASE COMPRISING SAME AS ACTIVE INGREDIENT TNF, IL6, LITAF XDH 575/4885ERN1 3761/4885KDM4E 1312/4885

“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.