SCHEMBL15912136

SCHEMBL15912136

C=CCOC(=O)CS(=O)(=O)OCC=C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
TDP1 Q9NUW8 1/20 0.39
CYP3A4 P08684 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
PKM P14618 1/20 0.35
MAPT P10636 1/20 0.34
CACNA1B Q00975 1/20 0.34
APBA1 Q02410 1/20 0.34
ALDH1A1 P00352 2/20 0.33
GAA P10253 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL15912164 0.87 KMT2A (0.39) TSHRTDP1CYP3A4NPSR1SMN1; SMN2
SCHEMBL15912138 0.83 TSHR (0.36) TSHRTDP1CYP3A4NPSR1SMN1; SMN2
SCHEMBL15800900 0.83 CA12 (0.32)
SCHEMBL15912149 0.82 ALDH1A1 (0.39) TSHRTDP1MAPTCACNA1BAPBA1
SCHEMBL15912166 0.82 TSHR (0.44) TSHRTDP1CYP3A4NPSR1SMN1; SMN2
SCHEMBL15800948 0.82 TDP1 (0.38) TSHRTDP1
SCHEMBL253115 0.79 TSHR (0.44) TSHRTDP1CYP3A4NPSR1SMN1; SMN2
SCHEMBL15918779 0.79 POLB (0.39) CYP3A4MAPT
Ammonia Solution, Strong SCHEMBL28125183 0.78 TSHR (0.43) TSHRTDP1CYP3A4NPSR1SMN1; SMN2
SCHEMBL2526154 0.78 TSHR (0.43) TSHRTDP1CYP3A4NPSR1SMN1; SMN2

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
US-20140212770-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ulbe industries, Ltd. (JP) 2014-07-31 US disclosed
US-20140212770-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME Ulbe industries, Ltd. (JP) 2014-07-31 US disclosed