SCHEMBL6569862

SCHEMBL6569862

CCCC(O)C(C)CC(C)CO

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.54
LMNA P02545 2/20 0.46
TDP1 Q9NUW8 1/20 0.33
CYP2D6 P10635 2/20 0.32
TRPA1 O75762 2/20 0.32
SPHK1 Q9NYA1 2/20 0.32
GMNN O75496 1/20 0.32
POLB P06746 1/20 0.32
THPO P40225 1/20 0.32
MTOR P42345 1/20 0.32
BLM P54132 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
CETP P11597 1/20 0.32
HTT P42858 1/20 0.32
UBE2N P61088 1/20 0.32

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
SCHEMBL15205828 0.81 TSHR (0.40) TSHRLMNATDP1TRPA1
SCHEMBL8413806 0.81 TSHR (0.43) TSHRLMNA
SCHEMBL9147771 0.80
SCHEMBL2510465 0.80
SCHEMBL9147603 0.80
SCHEMBL9274802 0.78 LMNA (0.41) TSHRLMNASPHK1
SCHEMBL5907165 0.76 TSHR (0.59) TSHRLMNATDP1CYP2D6TRPA1
SCHEMBL14433121 0.76 TSHR (0.59) TSHRLMNATDP1CYP2D6TRPA1
SCHEMBL294810 0.75 TSHR (0.74) TSHRLMNATDP1TRPA1
SCHEMBL17967785 0.75 TSHR (0.74) TSHRLMNATDP1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040204524-A1 Solvent-containing mixtures which can be cured physically or thermally and/or by means of actinic radiation, method of production and use thereof BASF COATINGS AKTIENGESELLSCHAFT (DE) 2004-10-14 US claimed
EP-1404767-A1 SOLVENT-CONTAINING MIXTURES WHICH CAN BE CURED PHYSICALLY OR THERMALLY AND/ OR BY MEANS OF ACTINIC RADIATION. METHOD FOR PRODUCTION AND USE THEREOF BASF Coatings AG (DE) 2004-04-07 EP claimed
WO-2003000809-A1 SOLVENT-CONTAINING MIXTURES WHICH CAN BE CURED PHYSICALLY OR THERMALLY AND/ OR BY MEANS OF ACTINIC RADIATION. METHOD FOR PRODUCTION AND USE THEREOF BASF COATINGS AG (DE) 2003-01-03 WO claimed
CN-108210564-A It is a kind of to treat four leaf moxa stick of rheumatism and preparation method 黄建民 2018-06-29 CN disclosed
US-20040204524-A1 Solvent-containing mixtures which can be cured physically or thermally and/or by means of actinic radiation, method of production and use thereof BASF COATINGS AKTIENGESELLSCHAFT (DE) 2004-10-14 US disclosed
EP-1404767-A1 SOLVENT-CONTAINING MIXTURES WHICH CAN BE CURED PHYSICALLY OR THERMALLY AND/ OR BY MEANS OF ACTINIC RADIATION. METHOD FOR PRODUCTION AND USE THEREOF BASF Coatings AG (DE) 2004-04-07 EP disclosed
WO-2003000809-A1 SOLVENT-CONTAINING MIXTURES WHICH CAN BE CURED PHYSICALLY OR THERMALLY AND/ OR BY MEANS OF ACTINIC RADIATION. METHOD FOR PRODUCTION AND USE THEREOF BASF COATINGS AG (DE) 2003-01-03 WO disclosed