SCHEMBL52072

SCHEMBL52072

CC[n+]1ccn(C)c1.Cc1ccc(S(=O)(=O)[O-])cc1

nearest known ligand 0.40

Known targets — ChEMBL curated mechanism

CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA

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 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.40
KDM4E B2RXH2 5/20 0.37
MAPT P10636 2/20 0.37
HSD17B10 Q99714 1/20 0.37
LMNA P02545 3/20 0.36
CYP3A4 P08684 3/20 0.36
MAPK1 P28482 2/20 0.36
CYP2D6 P10635 1/20 0.36
THPO P40225 1/20 0.36
RAPGEF4 Q8WZA2 1/20 0.36
ALDH1A1 P00352 5/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
GAA P10253 1/20 0.35
CYP2C9 P11712 3/20 0.34
CYP2C19 P33261 2/20 0.34
TERT O14746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MEN1 O00255 1/20 0.34
HPGD P15428 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
SCHEMBL2935750 0.88 PSIP1 (0.37) HTTKDM4EMAPTLMNACYP3A4
SCHEMBL2230706 0.86 KDM4E (0.47) HTTKDM4EMAPTCYP3A4ALDH1A1
SCHEMBL28977649 0.85 HTT (0.32) HTT
SCHEMBL5546185 0.84 HTT (0.39) HTTKDM4EMAPTHSD17B10LMNA
SCHEMBL28365668 0.84 KDM4E (0.48) HTTKDM4ECYP3A4ALDH1A1CYP2C9
SCHEMBL7195917 0.84 KDM4E (0.48) HTTKDM4ECYP3A4ALDH1A1CYP2C9
SCHEMBL28026186 0.84 KDM4E (0.48) HTTKDM4ECYP3A4ALDH1A1CYP2C9
SCHEMBL14720657 0.84 KDM4E (0.48) HTTKDM4ECYP3A4ALDH1A1CYP2C9
SCHEMBL27227739 0.83 HTT (0.37) HTTKDM4EHSD17B10LMNACYP3A4
SCHEMBL3031196 0.83 CA1 (0.35) HTTKDM4EMAPTHSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250382408-A1 EPOXY-TERMINATED ISOCYANATE PREPOLYMERS, AND PROCESS FOR THE PREPARATION THEREOF BASF SE (DE) 2025-12-18 US claimed
US-12226215-B2 Conductive polymeric composition and method for preparing the conductive polymeric composition Giuseppe USAI (IT) 2025-02-18 US claimed
CN-119403855-A Epoxy blocked isocyanate prepolymer and method for producing same 巴斯夫欧洲公司 2025-02-07 CN claimed
US-20240336833-A1 POLYCANNABINOIDS FOR COMMODITY POLYMERS AND COMMODITY ELECTRONICS UNIVERSITY OF CONNECTICUT 2024-10-10 US claimed
EP-3986978-B1 AQUEOUS DELAYED ACID SYSTEM FOR WELL STIMULATION BAKER HUGHES HOLDINGS LLC (US) 2024-05-15 EP claimed
CN-111117594-B Electrochromic material and electrochromic device based on dynamic metal-ligand complexation 吉林大学 2024-03-26 CN claimed
US-11932813-B2 Electrochromic materials; preparation and use thereof UNIVERSITY OF CONNECTICUT (US) 2024-03-19 US claimed
CN-115010836-B Electrochromic polymer, nano particle and device 吉林大学 2023-09-08 CN claimed
US-11567385-B2 Electrochromic device THE BOEING COMPANY (US) 2023-01-31 US claimed
US-20220396728-A1 ELECTROCHROMIC MATERIALS; PREPARATION AND USE THEREOF UNIVERSITY OF CONNECTICUT 2022-12-15 US claimed
WO-2006105037-A2 ELECTROCHEMICAL DEBLOCKING SOLUTION FOR ELECTROCHEMICAL OLIGOMER SYNTHESIS ON AN ELECTRODE ARRAY COMBIMATRIX CORPORATION (US) 2006-10-05 WO claimed
US-20060203322-A1 Gel polymers containing ionic liquids ARMY, UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF THE 2006-09-14 US claimed
WO-2006094052-A2 GEL POLYMER ELECTROLYTES TRITON SYSTEMS, INC. (US) 2006-09-08 WO claimed
WO-2006045518-A1 METHOD FOR SEPARATING GAS SOLVAY FLUOR GMBH (DE) 2006-05-04 WO claimed
WO-2006031814-A2 ELECTROCHEMICAL DEBLOCKING USING A HYDRAZINE DERIVATIVE COMBIMATRIX CORPORATION (US) 2006-03-23 WO claimed
US-20060054511-A1 Electrochemical deblocking using a hydrazine derivative CUSTOMARRAY, INC. 2006-03-16 US claimed
WO-2005083829-A2 PROTECTED ACTIVE METAL ELECTRODE AND BATTERY CELL STRUCTURES WITH NON-AQUEOUS INTERLAYER ARCHITECTURE POLYPLUS BATTERY COMPANY (US) 2005-09-09 WO claimed
US-20050175894-A1 Prevents the active metal from deleterious reaction with the environment on the other (cathode) side of the impervious layer, which may include aqueous or non-aqueous liquid electrolytes (catholytes) and/or a variety electrochemically active materials, including liquid, solid and gaseous oxidizers POLYPLUS BATTERY COMPANY 2005-08-11 US claimed
WO-2005038962-A2 IONICALLY CONDUCTIVE MEMBRANES FOR PROTECTION OF ACTIVE METAL ANODES AND BATTERY CELLS POLYPLUS BATTERY COMPANY (US) 2005-04-28 WO claimed
US-20040191617-A1 Chemical resistance; anodes, cathodes; protective membrane coating POLYPLUS BATTERY COMPANY 2004-09-30 US claimed