SCHEMBL249850

SCHEMBL249850

CC(CC(=O)O)C(C)(C)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
SLC22A6 Q4U2R8 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
CACNA2D1 P54289 2/20 0.35
ADRA1A P35348 2/20 0.35
CACNB3 P54284 1/20 0.35
CACNA1C Q13936 1/20 0.35
PGR P06401 1/20 0.35
HTR2B P41595 1/20 0.35
CACNA2D2 Q9NY47 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HMGCR P04035 1/20 0.35
CHRM1 P11229 1/20 0.35
TBXA2R P21731 1/20 0.35
PGD P52209 1/20 0.34
MAPT P10636 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
Ammonia Solution, Strong SCHEMBL8858462 0.98 TDP1 (0.40) TSHRCYP2D6CYP2C19HIF1ASLC22A6
Ammonia Solution, Strong SCHEMBL8858461 0.98 TDP1 (0.40) TSHRCYP2D6CYP2C19HIF1ASLC22A6
Tetramethylammonium Ion SCHEMBL8858617 0.93 MAPT (0.39) TSHRCYP2D6CYP2C19HIF1ASLC22A6
SCHEMBL28276563 0.86 HSPD1 (0.33) TSHRCYP2D6CYP2C19HIF1ATDP1
SCHEMBL28080184 0.82 TSHR (0.48) TSHRHIF1AALDH1A1MAPTLMNA
SCHEMBL8372729 0.80 TSHR (0.39) TSHRCYP2D6CYP2C19HIF1ASLC22A6
SCHEMBL9736134 0.79 TDP1 (0.38) TSHRCYP2D6CYP2C19HIF1ATDP1
SCHEMBL4610847 0.79 TET2 (0.33) TSHRCYP2D6CYP2C19HIF1ATDP1
SCHEMBL23913764 0.79 SLC22A6 (0.41) TSHRCYP2D6CYP2C19HIF1ASLC22A6
SCHEMBL20711453 0.79 SLC22A6 (0.41) TSHRCYP2D6CYP2C19HIF1ASLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114195649-B Method for separating and preparing single component of diaminotoluene mixture 王玉辉 2024-12-31 CN claimed
US-12180413-B2 Solid coolant concentrates and production thereof BASF SE (DE) 2024-12-31 US claimed
US-20240409801-A1 SOLID COOLANT CONCENTRATES AND PRODUCTION THEREOF BASF SE (DE) 2024-12-12 US claimed
US-20240110088-A1 COOLANTS WITH IMPROVED TEMPERATURE STABILITY BASF SE (DE) 2024-04-04 US claimed
US-20240052228-A1 SOLID COOLANT CONCENTRATES AND PRODUCTION THEREOF BASE SE (DE) 2024-02-15 US claimed
EP-4305124-A1 SOLID COOLANT CONCENTRATES AND PRODUCTION THEREOF BASF SE (DE) 2024-01-17 EP claimed
CN-117043301-A Solid coolant concentrate and preparation thereof 巴斯夫欧洲公司 2023-11-10 CN claimed
CN-116649327-A Application of HMG-CoA and pharmaceutically acceptable salts thereof in preparation of platelet preservative 中国人民解放军空军军医大学 2023-08-29 CN claimed
CN-111225795-B Method for manufacturing a particle-filled fibre preform 赛峰集团陶瓷 2023-03-28 CN claimed
EP-3356375-B1 PROCESS FOR RECOVERING A MIXTURE COMPRISING A (THIO)PHOSPHORIC ACID DERIVATIVE BASF SE (DE) 2023-01-04 EP claimed
WO-2015192184-A1 GRAFFITI REMOVAL COMPOSITIONS AND THE USE THEREOF GUARD IT SOLUTIONS PTY LTD (AU) 2015-12-23 WO claimed
US-8927189-B2 Photoresist composition and method of manufacturing display device using same SAMSUNG DISPLAY CO., LTD. (KR) 2015-01-06 US claimed
US-20140242515-A1 PHOTORESIST COMPOSITION AND METHOD OF MANUFACTURING DISPLAY DEVICE USING SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-08-28 US claimed
US-8771925-B2 Flexographic processing solution and method of use EASTMAN KODAK COMPANY (US) 2014-07-08 US claimed
US-8258080-B2 Tissue markings and methods for reversibly marking tissue employing the same PERFORMANCE INDICATOR, LLC (US) 2012-09-04 US claimed
EP-2470963-A1 PROCESSING SOLUTION FOR FLEXOGRAPHIC PRINTING PLATES AND METHOD OF USE Eastman Kodak Company (US) 2012-07-04 EP claimed
US-20120003301-A1 TISSUE MARKINGS AND METHODS FOR REVERSIBLY MARKING TISSUE EMPLOYING THE SAME PERFORMANCE INDICATOR LLC (US) 2012-01-05 US claimed
WO-2011025523-A1 PROCESSING SOLUTION FOR FLEXOGRAPHIC PRINTING PLATES AND METHOD OF USE EASTMAN KODAK COMPANY (US) 2011-03-03 WO claimed
EP-1748060-A1 Tattoo inks Freedom-2, LLC (US) 2007-01-31 EP claimed
EP-1107724-B1 TATTOO INKS FREEDOM 2 LLC (US) 2006-12-13 EP claimed