SCHEMBL10965451

SCHEMBL10965451

CCCCCC[C@H](C=CC1C(O[Si](C)(C)C(C)(C)C)CC(=O)C1CO)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGIR P43119 8/20 0.38
▸ TSHR P16473 3/20 0.38
▸ PTGER4 P35408 3/20 0.38
▸ PTGER2 P43116 3/20 0.38
▸ HPGD P15428 2/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ABCC3 O15438 1/20 0.38
▸ ABCC4 O15439 1/20 0.38
▸ RARB P10826 1/20 0.38
▸ RARG P13631 1/20 0.38
▸ DRD1 P21728 1/20 0.38
▸ NR4A2 P43354 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ NR1I2 O75469 1/20 0.35
▸ ESR1 P03372 1/20 0.35

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
SCHEMBL10965448 1.00 PTGIR (0.38) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL10963649 0.99 PTGIR (0.37) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL10964047 0.99 PTGIR (0.37) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL10964037 0.99 PTGIR (0.37) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL10963646 0.99 PTGIR (0.37) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL10966307 0.89 PTGIR (0.35) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL11073184 0.89 PTGIR (0.35) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL11073179 0.89 PTGIR (0.35) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL10966301 0.89 PTGIR (0.35) PTGIRTSHRPTGER4PTGER2HPGD
SCHEMBL11036711 0.88 PTGIR (0.35) PTGIRTSHRPTGER4PTGER2HPGD

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-0051284-B1 NOVEL THIAPROSTAGLANDIN E1 DERIVATIVES, PROCESS FOR PRODUCTION THEREOF, AND PHARMACEUTICALS CONTAINING THESE COMPOUNDS TEIJIN LIMITED (JP) 1985-01-09 — — EP disclosed
US-4466980-A Thiaprostaglandin E1 derivatives, process for production thereof, and pharmaceutical use thereof TEIJIN LIMITED (JP) 1984-08-21 — — US disclosed
EP-0051284-A1 Novel thiaprostaglandin E1 derivatives, process for production thereof, and pharmaceuticals containing these compounds TEIJIN LIMITED (JP) 1982-05-12 — — EP disclosed
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