SCHEMBL11067100

SCHEMBL11067100

CCCCC[C@H](C=CC1C(=O)CC(O[Si](C)(C)CCCC)C1COS(C)(=O)=O)O[Si](C)(C)CCCC

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.34
▸ SLCO2A1 Q92959 1/20 0.34
▸ PTGDR2 Q9Y5Y4 1/20 0.34

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
SCHEMBL11071090 0.79 PTGIR (0.33) —
SCHEMBL11071088 0.79 PTGIR (0.33) —
SCHEMBL11038780 0.71 PTGIR (0.34) —
SCHEMBL11038783 0.71 PTGIR (0.34) —
SCHEMBL10354094 0.63 PTGER3 (0.32) —
SCHEMBL10354093 0.63 PTGER3 (0.32) —
SCHEMBL11113796 0.63 TSHR (0.31) —
SCHEMBL5285758 0.62 CA1 (0.31) —
SCHEMBL9015293 0.62 TSHR (0.34) —
SCHEMBL11401490 0.61 PTGIR (0.33) ALDH1A1

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-4466980-A Thiaprostaglandin E1 derivatives, process for production thereof, and pharmaceutical use thereof TEIJIN LIMITED (JP) 1984-08-21 — — US disclosed
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