SCHEMBL7592946

SCHEMBL7592946

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

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.38
TSHR P16473 3/20 0.36
ALDH1A1 P00352 1/20 0.36
TP53 P04637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
GABRR1 P24046 2/20 0.32
LMNA P02545 2/20 0.32
PGD P52209 1/20 0.31
FOLH1 Q04609 1/20 0.30

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
SCHEMBL10866600 0.79 SLC22A6 (0.41) SLC22A6TSHRALDH1A1TP53TDP1
SCHEMBL1707381 0.75 LMNA (0.36) TSHRALDH1A1TP53LMNA
SCHEMBL9504373 0.75 SLC22A6 (0.38) SLC22A6TSHRALDH1A1TP53TDP1
SCHEMBL1132009 0.72 SLC22A6 (0.39) SLC22A6TSHRTDP1SMN1; SMN2GABRR1
SCHEMBL898837 0.71 CHRM1 (0.41) TSHRALDH1A1TP53TDP1
SCHEMBL10704420 0.69
SCHEMBL3369505 0.69 CA2 (0.42)
SCHEMBL3368465 0.67 GPR84 (0.44)
SCHEMBL6463740 0.67 SLC22A6 (0.35) SLC22A6TSHRTDP1SMN1; SMN2GABRR1
SCHEMBL45165 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023008248-A1 REACTIVE MATERIAL AND THIN FILM PRODUCTION METHOD 株式会社ADEKA 2023-02-02 WO disclosed
EP-0981655-B1 CHEMICAL VAPOUR DEPOSITION PRECURSORS QINETIQ LTD (GB) 2002-10-16 EP disclosed
US-6383669-B1 COMPRISING ZIRCONIUM COMPLEXES WITH A BETA-DIKETONATE AND ALKANOL GROUPS; ELECTRO-CERAMIC DEVICES THEREFROM; USE IN FERRO-ELECTRIC MEMORIES AND INFRA-RED DETECTORS; ZIRCONIUM DIISOPROPOXY BIS(TETRAMETHYLHEPTANEDIOATE) FOR EXAMPLE THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 2002-05-07 US disclosed
EP-0981655-A2 CHEMICAL VAPOUR DEPOSITION PRECURSORS Secretary of State for Defence acting through his Defence Evaluation and Research Agency (GB) 2000-03-01 EP disclosed
WO-1998051837-A2 CHEMICAL VAPOUR DEPOSITION PRECURSORS SECRETARY OF STATE FOR DEFENCE ACTING THROUGH HIS DEFENCE EVALUATION AND RESEARCH AGENCY (GB) 1998-11-19 WO disclosed