SCHEMBL11046421

SCHEMBL11046421

CCCCCC(C=CC1C(OC2CCCCO2)CC(=O)C1C(O)CCCCCC(=O)OC)OC1CCCCO1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 4/20 0.37
▸ PTGER3 P43115 4/20 0.36
▸ PTGER4 P35408 4/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ HKDC1 Q2TB90 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ SAE1 Q9UBE0 1/20 0.35
▸ UBA2 Q9UBT2 1/20 0.35
▸ PTGER2 P43116 5/20 0.35
▸ TSHR P16473 2/20 0.35
▸ PTGIR P43119 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ABCC3 O15438 1/20 0.35
▸ ABCC4 O15439 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
SCHEMBL11398615 1.00 PDE4D (0.37) PDE4DPTGER3PTGER4ALDH1A1KDM4E
SCHEMBL11046420 1.00 PDE4D (0.37) PDE4DPTGER3PTGER4ALDH1A1KDM4E
SCHEMBL11381032 0.86 PDE4D (0.37) PDE4DPTGER3PTGER4ALDH1A1KDM4E
SCHEMBL11250679 0.84 PTGER2 (0.40) PDE4DPTGER3PTGER4ALDH1A1KDM4E
SCHEMBL11250676 0.84 PTGER2 (0.40) PDE4DPTGER3PTGER4ALDH1A1KDM4E
SCHEMBL11245406 0.84 — —
SCHEMBL11245403 0.84 — —
SCHEMBL11245401 0.84 — —
SCHEMBL11389584 0.80 PTGER3 (0.34) PDE4DPTGER3PTGER4ALDH1A1KDM4E
SCHEMBL10974182 0.80 PDE4D (0.47) PDE4DPTGER4ALDH1A1KDM4EHKDC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0038613-B1 NOVEL PROSTAGLANDINS E1 AND ANTI-THROMBOTIC COMPOSITIONS CONTAINING THEM TEIJIN LIMITED (JP) 1984-08-29 — — EP disclosed
US-4315032-A ANTITHROMBOGENIC AGENTS, ANTIULCER AGENTS TEITIN LIMITED (JP) 1982-02-09 — — US disclosed
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