SCHEMBL29300052

SCHEMBL29300052

CCOCCOCC(C)F

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.37
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL15890322 0.86
SCHEMBL3780292 0.81 ALDH1A1 (0.39) ALDH1A1HSD17B10TSHRTHRB
SCHEMBL7149639 0.78 ALDH1A1 (0.41) ALDH1A1HSD17B10TSHRTHRBTDP1
SCHEMBL28847000 0.77 ALDH1A1 (0.42) ALDH1A1HSD17B10TSHRTHRBTDP1
SCHEMBL29300055 0.77 HSD17B10 (0.31) HSD17B10
SCHEMBL15754892 0.76
SCHEMBL24335013 0.76
SCHEMBL12754639 0.76 ALDH1A1 (0.39) ALDH1A1HSD17B10TSHRTHRBTDP1
SCHEMBL25845172 0.76
SCHEMBL7146848 0.76 ALDH1A1 (0.39) ALDH1A1HSD17B10TSHRTHRBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024145810-A1 ELECTROLYTE SOLUTION, SECONDARY BATTERY COMPRISING SAME, AND ELECTRIC DEVICE 宁德时代新能源科技股份有限公司 2024-07-11 WO disclosed