SCHEMBL11568205

SCHEMBL11568205

CCCC[C@@H](F)[C@@H](CC[C@H]1CC[C@H](O)[C@@H]1C/C=C\CCC(C)C(=O)O)OC1CCCCO1

nearest known ligand 0.31

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PTGFR P43088 2/20 0.31
▸ LMNA P02545 2/20 0.30
▸ HPGD P15428 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ HIF1A Q16665 1/20 0.30
▸ ALDH1A1 P00352 2/20 0.30
▸ TBXA2R P21731 1/20 0.30
▸ PTGER1 P34995 1/20 0.30
▸ PTGER4 P35408 1/20 0.30
▸ PTGER3 P43115 1/20 0.30
▸ PTGDR Q13258 1/20 0.30
▸ SLCO2A1 Q92959 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
SCHEMBL11372858 0.77 TBXA2R (0.43) PTGFRLMNAHPGDTSHRMAPK1
SCHEMBL11367013 0.77 TBXA2R (0.43) PTGFRLMNAHPGDTSHRMAPK1
SCHEMBL11366261 0.74 TBXA2R (0.46) PTGFRLMNAHPGDTSHRMAPK1
SCHEMBL11847227 0.74 PTGFR (0.32) PTGFRLMNAHPGDTSHRMAPK1
SCHEMBL11374469 0.72 PTGER4 (0.44) PTGFRLMNAHPGDTSHRMAPK1
SCHEMBL11741757 0.71 PTGFR (0.40) PTGFRLMNAHPGDTSHRMAPK1
SCHEMBL11724527 0.70 TBXA2R (0.34) PTGFRLMNAHPGDTSHRMAPK1
SCHEMBL11717810 0.70 TBXA2R (0.32) PTGFRTBXA2RPTGER1PTGER3
SCHEMBL11508719 0.68 TBXA2R (0.31) PTGFRALDH1A1TBXA2R
SCHEMBL11508721 0.68 TBXA2R (0.31) PTGFRALDH1A1TBXA2R

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-0000207-A1 Prostaglandin derivatives, their preparation and pharmaceutical compositions and intermediates F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1979-01-10 — — EP disclosed
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