SCHEMBL11840472

SCHEMBL11840472

CCCCCC/C=C/[C@H]1CC[C@H](OC(C)=O)[C@@H]1C/C=C\CCC(OC1CCCCO1)(OC1CCCCO1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 4/20 0.33
▸ TBXA2R P21731 7/20 0.33

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
SCHEMBL11632131 0.92 PDE4D (0.35) PDE4DTBXA2R
SCHEMBL11780570 0.88 PTGFR (0.35) TBXA2R
SCHEMBL11633368 0.88 PTGFR (0.35) TBXA2R
SCHEMBL11841851 0.87 TBXA2R (0.33) TBXA2R
SCHEMBL11844308 0.87 TBXA2R (0.33) TBXA2R
SCHEMBL11848414 0.85 PDE4D (0.35) PDE4DTBXA2R
SCHEMBL11846710 0.83 TBXA2R (0.31) TBXA2R
SCHEMBL11844066 0.81 PDE4D (0.38) PDE4DTBXA2R
SCHEMBL11879711 0.81 PDE4D (0.31) PDE4D
SCHEMBL11515788 0.80 PDE4D (0.33) PDE4DTBXA2R

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-3997587-A D1- and 8R-9-fluoro-prostadienoic acid derivatives SYNTEX (U.S.A.) INC. (US) 1976-12-14 — — US disclosed
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