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Sugi Predict / Compounds / SCHEMBL6654963

SCHEMBL6654963

SCHEMBL6654963

CCCC[C@@H](C)C[C@@H](/C=C/[C@@H]1C(SCCCCCC(=O)O)=C(OC(=O)c2ccccc2)C[C@H]1O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 2/20 0.40
▸ PTGER4 P35408 1/20 0.30
▸ PTGER3 P43115 1/20 0.30
▸ PTGER2 P43116 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
SCHEMBL6654967 1.00 PTGIR (0.40) PTGIRPTGER4PTGER3PTGER2
SCHEMBL8622590 0.94 PTGIR (0.34) PTGIR
SCHEMBL6655437 0.93 PTGIR (0.36) PTGIRPTGER4PTGER3PTGER2
SCHEMBL6655434 0.93 PTGIR (0.36) PTGIRPTGER4PTGER3PTGER2
SCHEMBL8622592 0.92 PTGIR (0.31) PTGIR
SCHEMBL6656530 0.91 PTGIR (0.40) PTGIRPTGER4PTGER3PTGER2
SCHEMBL6656528 0.91 PTGIR (0.40) PTGIRPTGER4PTGER3PTGER2
SCHEMBL6658337 0.90 PTGIR (0.40) PTGIRPTGER4PTGER3PTGER2
SCHEMBL6651337 0.90 PTGIR (0.40) PTGIRPTGER4PTGER3PTGER2
SCHEMBL6658339 0.90 PTGIR (0.40) PTGIRPTGER4PTGER3PTGER2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0695741-B1 7-THIAPROSTAGLANDINS AND PROCESS FOR PRODUCING THE SAME TEIJIN LTD (JP) 2004-06-16 — — EP disclosed
US-5731452-A 7-thiaprostaglandins and method of production thereof TEIJIN LIMITED (JP) 1998-03-24 — — US disclosed
EP-0695741-A1 7-THIAPROSTAGLANDINS AND PROCESS FOR PRODUCING THE SAME TEIJIN LIMITED (JP) 1996-02-07 — — EP disclosed
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