SCHEMBL24452995

SCHEMBL24452995

O=C(Cc1ccc(C2CO2)cc1)OC(CS(=O)(=O)O)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.33
TSHR P16473 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
SCHEMBL18775770 0.80 TSHR (0.50) TSHR
SCHEMBL24452961 0.75 MGLL (0.36) MGLL
SCHEMBL24465266 0.75 PARP1 (0.46) MGLLTSHR
SCHEMBL24453055 0.75 GSTO1 (0.31) TSHR
SCHEMBL24452990 0.73 MGLL (0.42) MGLLTSHR
SCHEMBL20009235 0.72 CETP (0.40) TSHR
SCHEMBL20012805 0.71 MEN1 (0.48)
SCHEMBL20009236 0.71 CTBP2 (0.39) TSHR
SCHEMBL23501381 0.70 CYP4F2 (0.53) MGLL
SCHEMBL21287025 0.68 CYP4F2 (0.38)

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
US-20220160281-A1 BIO-ELECTRODE COMPOSITION, BIO-ELECTRODE, METHOD FOR MANUFACTURING BIO-ELECTRODE, AND REACTION COMPOSITE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-05-26 US disclosed