SCHEMBL7937882

SCHEMBL7937882

COCCCCOC(=O)CS.O=C(CS)OCC(COC(=O)CS)(COC(=O)CS)COC(=O)CS

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
HSD17B10 Q99714 1/20 0.39
ALDH1A1 P00352 1/20 0.37
NAAA Q02083 1/20 0.36
RAD52 P43351 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.31
FAAH O00519 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HTR2C P28335 1/20 0.30

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
SCHEMBL1050085 0.89 TSHR (0.48) TSHRHSD17B10ALDH1A1NAAARAD52
SCHEMBL9420634 0.87 ALDH1A1 (0.48) TSHRHSD17B10ALDH1A1NAAARAD52
SCHEMBL9420608 0.87 ALDH1A1 (0.48) TSHRHSD17B10ALDH1A1NAAARAD52
SCHEMBL9420849 0.87 ALDH1A1 (0.48) TSHRHSD17B10ALDH1A1NAAARAD52
SCHEMBL5175741 0.85 TSHR (0.48) TSHRHSD17B10ALDH1A1NAAARAD52
SCHEMBL20664518 0.83 TSHR (0.46) TSHRHSD17B10
SCHEMBL60561 0.80 TSHR (0.43) TSHRHSD17B10ALDH1A1
SCHEMBL60931 0.78 NAAA (0.46) TSHRHSD17B10ALDH1A1NAAARAD52
SCHEMBL24860480 0.76 ALDH1A1 (0.42) TSHRHSD17B10ALDH1A1NAAARAD52
SCHEMBL2586859 0.76

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-6242149-B1 LIGHT SENSITIVE ELEMENTS CURED WITH RADIATION, RADICAL POLYMERIZATION, PHOTOPOLYMERIZATION, ENCAPSULATION BROTHER KOGYO KABUSHIKI KAISHA (JP) 2001-06-05 US claimed