SCHEMBL9436878

SCHEMBL9436878

C=C(C)C(=O)OC(C)NS(=O)(=O)CCCCCCCCF

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.33
ALDH1A1 P00352 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
SCHEMBL8565011 0.87 TSHR (0.44) TSHR
SCHEMBL9436877 0.72 TSHR (0.43) TSHRALDH1A1
SCHEMBL9577722 0.72 MMP2 (0.32)
SCHEMBL10712700 0.71 FAAH (0.41) TSHRALDH1A1
SCHEMBL10064117 0.70 ALDH1A1 (0.36) TSHRALDH1A1
SCHEMBL9436876 0.69 TSHR (0.40) TSHR
SCHEMBL8560751 0.68 TSHR (0.39) TSHR
SCHEMBL717201 0.67 TSHR (0.35) TSHRALDH1A1
SCHEMBL5940425 0.66 TSHR (0.34) TSHRALDH1A1
SCHEMBL7615808 0.66 CA1 (0.46) TSHRALDH1A1

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
EP-0582667-A1 FLUOROACRYLATE MONOMERS AND POLYMERS, PROCESSES FOR PREPARING THE SAME AND THEIR USE. MINNESOTA MINING & MFG (US) 1994-02-16 EP disclosed