SCHEMBL7744429

SCHEMBL7744429

Oc1ccc2ccc3cccc4ccc1c2c34.[Na].[Na].[Na]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.52
HSD17B10 Q99714 5/20 0.52
ALDH1A1 P00352 5/20 0.52
CYP1A2 P05177 5/20 0.52
TSHR P16473 3/20 0.52
CYP3A4 P08684 2/20 0.52
CYP1A1 P04798 1/20 0.52
CYP1B1 Q16678 1/20 0.52
TDP1 Q9NUW8 2/20 0.52
THRB P10828 2/20 0.52
MAPT P10636 2/20 0.52
APP P05067 1/20 0.52
ALOX15 P16050 1/20 0.52
CASP1 P29466 1/20 0.52
SNCA P37840 1/20 0.52
RECQL P46063 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
ERBB2 P04626 1/20 0.48
FYN P06241 1/20 0.48
MAOA P21397 1/20 0.48

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
SCHEMBL29362339 0.98 HPGD (0.55) HPGDHSD17B10ALDH1A1CYP1A2TSHR
SCHEMBL29571791 0.98 HPGD (0.55) HPGDHSD17B10ALDH1A1CYP1A2TSHR
SCHEMBL218996 0.98 HPGD (0.55) HPGDHSD17B10ALDH1A1CYP1A2TSHR
SCHEMBL7744427 0.95 HPGD (0.52) HPGDHSD17B10ALDH1A1CYP1A2TSHR
Methane SCHEMBL28526267 0.95 HPGD (0.52) HPGDHSD17B10ALDH1A1CYP1A2TSHR
SCHEMBL27927698 0.95 HPGD (0.52) HPGDHSD17B10ALDH1A1CYP1A2TSHR
SCHEMBL8337349 0.95 HPGD (0.52) HPGDHSD17B10ALDH1A1CYP1A2TSHR
SCHEMBL28329629 0.95 HPGD (0.52) HPGDHSD17B10ALDH1A1CYP1A2TSHR
Methyl Alcohol SCHEMBL28626522 0.93 HPGD (0.56) HPGDHSD17B10ALDH1A1CYP1A2TSHR
Formaldehyde SCHEMBL28058196 0.91 HPGD (0.48) HPGDHSD17B10ALDH1A1CYP1A2TSHR

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110669243-B Antibacterial coating with pH monitoring function, functional material of antibacterial coating with pH monitoring function and preparation method of functional material 中国科学院长春应用化学研究所 2023-12-19 CN claimed
CN-113121025-B Trace type bio-based scale inhibitor and preparation method and application thereof 安阳工学院 2023-10-27 CN claimed
CN-116903158-A Formula of multifunctional circulating cooling water phosphate-free water treatment agent 郑州大学 2023-10-20 CN claimed
CN-116854264-A Formula of high-concentration-ratio circulating cooling water phosphate-free water treatment agent 郑州大学 2023-10-10 CN claimed
CN-116835780-A Formula of multi-component circulating cooling water phosphate-free water treatment agent 郑州大学 2023-10-03 CN claimed
CN-109655287-B Tire grounding state evaluation method 东洋橡胶工业株式会社 2020-12-08 CN claimed
CN-110669243-B Antibacterial coating with pH monitoring function, functional material of antibacterial coating with pH monitoring function and preparation method of functional material 中国科学院长春应用化学研究所 2023-12-19 CN disclosed
CN-113121025-B Trace type bio-based scale inhibitor and preparation method and application thereof 安阳工学院 2023-10-27 CN disclosed
CN-116903158-A Formula of multifunctional circulating cooling water phosphate-free water treatment agent 郑州大学 2023-10-20 CN disclosed
CN-116854264-A Formula of high-concentration-ratio circulating cooling water phosphate-free water treatment agent 郑州大学 2023-10-10 CN disclosed
CN-116835780-A Formula of multi-component circulating cooling water phosphate-free water treatment agent 郑州大学 2023-10-03 CN disclosed
CN-109655287-B Tire grounding state evaluation method 东洋橡胶工业株式会社 2020-12-08 CN disclosed
US-6426086-B1 MULTILAYER COMPLEX; DRUG DELIVERY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2002-07-30 US disclosed
US-5272260-A Reagents and methods for the determination of glycohydrolytic enzymes ABBOTT LABORATORIES (US) 1993-12-21 US disclosed
WO-1993015097-A1 REAGENTS AND METHODS FOR THE DETERMINATION OF GLYCOHYDROLYTIC ENZYMES ABBOTT LABORATORIES (US) 1993-08-05 WO disclosed