SCHEMBL4352039

SCHEMBL4352039

CS(=O)(=O)[O-].CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Ir+3]

nearest known ligand 0.50

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
CYP3A4 P08684 1/20 0.50
CA1 P00915 1/20 0.42
TSHR P16473 2/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
USP2 O75604 1/20 0.36
CA2 P00918 1/20 0.33

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
SCHEMBL4350805 0.89 KDM4E (0.50) KDM4ECYP3A4CA1TSHRMEN1
SCHEMBL4858286 0.89 KDM4E (0.50) KDM4ECYP3A4CA1TSHRMEN1
SCHEMBL20570026 0.89 KDM4E (0.50) KDM4ECYP3A4CA1TSHRMEN1
SCHEMBL23926540 0.89 KDM4E (0.50) KDM4ECYP3A4CA1TSHRMEN1
SCHEMBL22749162 0.89 KDM4E (0.50) KDM4ECYP3A4CA1TSHRMEN1
SCHEMBL23567016 0.89 KDM4E (0.50) KDM4ECYP3A4CA1TSHRMEN1
SCHEMBL20570539 0.89
SCHEMBL20570963 0.89 KDM4E (0.50) KDM4ECYP3A4CA1TSHRMEN1
SCHEMBL22581617 0.89 KDM4E (0.50) KDM4ECYP3A4CA1TSHRMEN1
SCHEMBL4812594 0.89 KDM4E (0.50) KDM4ECYP3A4CA1TSHRMEN1

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-3181576-B1 METHOD FOR SYNTHESIZING 25-HYDROXY CHOLESTEROL UNIV ZHEJIANG TECHNOLOGY (CN) 2019-09-04 EP claimed
US-9802977-B2 Method of synthesizing 25-hydroxy cholesterol ZHEJIANG UNIVERSITY OF TECHNOLOGY (CN) 2017-10-31 US claimed
EP-3181576-A1 METHOD FOR SYNTHESIZING 25-HYDROXY CHOLESTEROL Zhejiang University of Technology (CN) 2017-06-21 EP claimed
US-20170158729-A1 METHOD OF SYNTHESIZING 25-HYDROXY CHOLESTEROL ZHEJIANG UNIVERSITY OF TECHNOLOGY (CN) 2017-06-08 US claimed
US-12491503-B2 Hydrogenation process of oxime derivatives SYNGENTA CROP PROTECTION AG (CH) 2025-12-09 US disclosed
CN-113166183-B Method for hydrogenating oxime derivatives 先正达农作物保护股份公司 2025-04-22 CN disclosed
CN-113195460-B Enantioselective process 先正达农作物保护股份公司 2024-07-19 CN disclosed
EP-3877394-B1 HYDROGENATION PROCESS OF OXIME DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2024-06-26 EP disclosed
EP-3877372-B1 ENANTIOSELECTIVE REDUCTION OF OXIME-DERIVATIVES INVOLVING IRIDIUM BASED CATALYSTS SYNGENTA CROP PROTECTION AG (CH) 2023-08-02 EP disclosed
EP-3877372-A1 ENANTIOSELECTIVE PROCESS Syngenta Crop Protection AG (CH) 2021-09-15 EP disclosed
CN-113195460-A Enantioselective process 先正达农作物保护股份公司 2021-07-30 CN disclosed
CN-113166183-A Process for the hydrogenation of oxime derivatives 先正达农作物保护股份公司 2021-07-23 CN disclosed
EP-3181576-A1 METHOD FOR SYNTHESIZING 25-HYDROXY CHOLESTEROL Zhejiang University of Technology (CN) 2017-06-21 EP disclosed
US-20170158729-A1 METHOD OF SYNTHESIZING 25-HYDROXY CHOLESTEROL ZHEJIANG UNIVERSITY OF TECHNOLOGY (CN) 2017-06-08 US disclosed
EP-2043611-A2 METAL-CONTAINING FORMULATIONS AND METHODS OF USE Nucryst Pharmaceuticals Corp. (CA) 2009-04-08 EP disclosed
US-20080050452-A1 METAL-CONTAINING FORMULATIONS AND METHODS OF USE NUCRYST PHARMACEUTICALS 2008-02-28 US disclosed
US-20080044491-A1 METAL-CONTAINING FORMULATIONS AND METHODS OF USE NUCRYST PHARMACEUTICALS 2008-02-21 US disclosed
US-20080014278-A1 METAL-CONTAINING FORMULATIONS AND METHODS OF USE NUCRYST PHARMACEUTICALS 2008-01-17 US disclosed
US-20080014247-A1 METAL-CONTAINING FORMULATIONS AND METHODS OF USE NUCRYST PHARMACEUTICALS 2008-01-17 US disclosed
WO-2008005705-A2 METAL-CONTAINING FORMULATIONS AND METHODS OF USE NUCRYST PHARMACEUTICALS CORP. (CA) 2008-01-10 WO 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 (2 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-20170158729-A1 METHOD OF SYNTHESIZING 25-HYDROXY CHOLESTEROL CYP46A1, HMGCR, DHCR7 KDM4E 1418/4885CYP3A4 76/4885CA1 454/4885
US-12491503-B2 Hydrogenation process of oxime derivatives HMOX2, HAO2, PRDX5 KDM4E 1418/4885CYP3A4 186/4885CA1 722/4885

“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.