SCHEMBL5819682

SCHEMBL5819682

CC(C)C(O)CCCCCCN1C(=O)CCC[C@@H]1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 16/20 0.36
▸ PTGER3 P43115 8/20 0.36
▸ PTGER2 P43116 6/20 0.36
▸ MAPT P10636 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
SCHEMBL2210287 0.82 ALDH1A1 (0.41) PTGER4PTGER3PTGER2
SCHEMBL14453240 0.81 ALDH1A1 (0.39) PTGER4PTGER3PTGER2
SCHEMBL3675530 0.75 PTGER4 (0.35) PTGER4PTGER3PTGER2
SCHEMBL1401084 0.75 PDK2 (0.41) PTGER4PTGER3PTGER2
SCHEMBL24795959 0.75 PDK2 (0.41) PTGER4PTGER3PTGER2
SCHEMBL3679333 0.74 PDK2 (0.34) PTGER4PTGER3PTGER2
SCHEMBL6686327 0.72 PTGER4 (0.41) PTGER4PTGER3PTGER2
SCHEMBL6686330 0.72 PTGER4 (0.41) PTGER4PTGER3PTGER2
SCHEMBL21389332 0.70 DUT (0.33) —
SCHEMBL24795965 0.70 DUT (0.33) —

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-1613621-A1 PROSTAGLANDIN ANALOGS AS EP4 RECEPTOR AGONISTS Merck Frosst Canada Ltd. (CA) 2006-01-11 — — EP disclosed
WO-2004085430-A1 PROSTAGLANDIN ANALOGS AS EP4 RECEPTOR AGONISTS MERCK FROSST CANADA LTD. (CA) 2004-10-07 — — WO disclosed
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