SCHEMBL7698482

SCHEMBL7698482

C=CC(=O)NC(OCC)OCC

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.50
ACACB O00763 2/20 0.40
ALDH1A1 P00352 2/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
CYP2C19 P33261 1/20 0.34
HPGD P15428 1/20 0.31
TGM2 P21980 2/20 0.31
F13A1 P00488 1/20 0.31
TGM1 P22735 1/20 0.31
MGAM O43451 1/20 0.30
GAA P10253 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 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
SCHEMBL3394077 0.90 TSHR (0.45) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL29236235 0.84 TSHR (0.47) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL9485030 0.83 TSHR (0.50) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL368428 0.83 TSHR (0.56) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL1761096 0.82 TSHR (0.48) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL6904319 0.81 TSHR (0.47) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL6580192 0.80 TSHR (0.47) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL9262683 0.79 TSHR (0.45) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL10340176 0.79 TSHR (0.45) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL660975 0.79 TSHR (0.45) TSHRACACBALDH1A1MAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117986426-A Preparation method of emulsifier for waterproof emulsion 南通腾龙化工科技有限公司 2024-05-07 CN claimed
US-6339461-B1 Method for forming spacers, manufacturing method for a color filter having the spacers, and liquid crystal element formed by using the manufacturing method CANON KABUSHIKI KAISHA (JP) 2002-01-15 US disclosed