SCHEMBL11370789

SCHEMBL11370789

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TBXA2R P21731 7/20 0.52
▸ ALDH1A1 P00352 4/20 0.52
▸ LMNA P02545 4/20 0.52
▸ PTGFR P43088 3/20 0.52
▸ SLCO2A1 Q92959 3/20 0.52
▸ PTGER3 P43115 3/20 0.52
▸ PTGER1 P34995 2/20 0.52
▸ PTGER4 P35408 1/20 0.52
▸ PTGDR Q13258 1/20 0.52
▸ MEN1 O00255 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ HPGD P15428 2/20 0.47
▸ ABCC4 O15439 1/20 0.47
▸ PTGDR2 Q9Y5Y4 1/20 0.46
▸ TSHR P16473 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ PTGER2 P43116 1/20 0.43
▸ PGR P06401 1/20 0.42
▸ ADORA3 P0DMS8 1/20 0.42

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
SCHEMBL15112964 0.82 TBXA2R (0.52) TBXA2RALDH1A1LMNAPTGFRSLCO2A1
SCHEMBL11369089 0.80 PTGER4 (0.51) TBXA2RALDH1A1LMNAPTGFRSLCO2A1
SCHEMBL11300747 0.80 PTGFR (0.63) TBXA2RALDH1A1LMNAPTGFRSLCO2A1
SCHEMBL11372629 0.80 PTGER4 (0.51) TBXA2RALDH1A1LMNAPTGFRSLCO2A1
SCHEMBL11308478 0.80 PTGFR (0.63) TBXA2RALDH1A1LMNAPTGFRSLCO2A1
SCHEMBL11372858 0.80 TBXA2R (0.43) TBXA2RALDH1A1LMNAPTGFRSLCO2A1
SCHEMBL11367013 0.80 TBXA2R (0.43) TBXA2RALDH1A1LMNAPTGFRSLCO2A1
SCHEMBL19140364 0.78 PGR (0.63) TBXA2RALDH1A1LMNAPTGFRSLCO2A1
SCHEMBL1747671 0.77 PTGFR (0.71) TBXA2RALDH1A1LMNAPTGFRSLCO2A1
SCHEMBL3364894 0.77 PTGFR (0.71) TBXA2RALDH1A1LMNAPTGFRSLCO2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4163016-A ANTISECRETORY AGENTS, HYPOTENSIVE AGENTS, ANTIULCER AGENTS HOFFMANN-LA ROCHE INC. (US) 1979-07-31 — — US claimed
US-4306078-A 16-Substituted prostaglandins HOFFMANN-LA ROCHE INC. (US) 1981-12-15 — — US disclosed
US-4260818-A ANTISECRETORY, ANTIULCER, HYPOTENSIVE AGENTS HOFFMANN-LA ROCHE INC. (US) 1981-04-07 — — US disclosed
US-4212993-A 11-ALKYL-13-SATURATED-15-KETO-16-FLUORO, -ALKYL OR -TRIFLUOROMETHYL DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 1980-07-15 — — US disclosed
US-4204074-A ANTISECRETORY, HYPOTENSIVE, ANTIULCER HOFFMANN-LA ROCHE INC. (US) 1980-05-20 — — US disclosed
US-4163016-A ANTISECRETORY AGENTS, HYPOTENSIVE AGENTS, ANTIULCER AGENTS HOFFMANN-LA ROCHE INC. (US) 1979-07-31 — — US disclosed
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