SCHEMBL31067652

SCHEMBL31067652

C=C(C)C(=O)OS(=O)(=O)CC.[Na]

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
THRB P10828 1/20 0.41
TSHR P16473 3/20 0.39
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
SCHEMBL154125 0.98 ALDH1A1 (0.44) ALDH1A1THRBTSHRTDP1
Ammonia Solution, Strong SCHEMBL1252865 0.95 ALDH1A1 (0.42) ALDH1A1THRBTSHRTDP1
SCHEMBL28082900 0.95 ALDH1A1 (0.42) ALDH1A1THRBTSHRTDP1
SCHEMBL1255356 0.95 ALDH1A1 (0.42) ALDH1A1THRBTSHRTDP1
SCHEMBL154989 0.95 ALDH1A1 (0.42) ALDH1A1THRBTSHRTDP1
SCHEMBL28082904 0.95 ALDH1A1 (0.42) ALDH1A1THRBTSHRTDP1
SCHEMBL28082816 0.95 ALDH1A1 (0.42) ALDH1A1THRBTSHRTDP1
SCHEMBL721417 0.83 TSHR (0.41) ALDH1A1THRBTSHR
SCHEMBL28180107 0.81 TSHR (0.40) ALDH1A1THRBTSHR
SCHEMBL38652102 0.79 ALDH1A1 (0.37) ALDH1A1THRBTSHRTDP1

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
CN-118530611-A Active energy ray-curable composition and film DIC株式会社 2024-08-23 CN disclosed