SCHEMBL11633368

SCHEMBL11633368

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGFR P43088 2/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ TBXA2R P21731 3/20 0.34
▸ LMNA P02545 3/20 0.34
▸ SLCO2A1 Q92959 2/20 0.34
▸ PTGER1 P34995 1/20 0.34
▸ PTGER4 P35408 1/20 0.34
▸ PTGER3 P43115 1/20 0.34
▸ PTGDR Q13258 1/20 0.34
▸ HPGD P15428 2/20 0.34
▸ ABCC4 O15439 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ PTGDR2 Q9Y5Y4 3/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HKDC1 Q2TB90 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ SAE1 Q9UBE0 1/20 0.33
▸ UBA2 Q9UBT2 1/20 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
SCHEMBL11780570 1.00 PTGFR (0.35) PTGFRALDH1A1TBXA2RLMNASLCO2A1
SCHEMBL11632080 0.91 ALDH1A1 (0.35) PTGFRALDH1A1TBXA2RLMNAHPGD
SCHEMBL11635837 0.91 ALDH1A1 (0.35) PTGFRALDH1A1TBXA2RLMNAHPGD
SCHEMBL11652695 0.91 PTGFR (0.30) PTGFR
SCHEMBL11651681 0.91 — —
SCHEMBL11844308 0.90 TBXA2R (0.33) PTGFRTBXA2R
SCHEMBL11841851 0.90 TBXA2R (0.33) PTGFRTBXA2R
SCHEMBL11778033 0.90 — —
SCHEMBL11759785 0.89 ALDH1A1 (0.30) ALDH1A1
SCHEMBL11840472 0.88 PDE4D (0.33) TBXA2R

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
US-4110341-A Dithio prostaglandin derivatives ONO PHARMACEUTICAL COMPANY (JP) 1978-08-29 — — US disclosed
US-3997587-A D1- and 8R-9-fluoro-prostadienoic acid derivatives SYNTEX (U.S.A.) INC. (US) 1976-12-14 — — US disclosed
US-3989736-A INCREASED DURATION OF ACTION PFIZER INC. (US) 1976-11-02 — — US disclosed
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