SCHEMBL11064479

SCHEMBL11064479

CCCCCC(O)/C=C/C1CCC(=O)N1CC(O)CCCCCO

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 19/20 0.64
▸ PTGER2 P43116 12/20 0.64
▸ PTGER3 P43115 11/20 0.64

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
SCHEMBL11064480 1.00 PTGER4 (0.64) PTGER4PTGER2PTGER3
SCHEMBL11067999 0.88 PTGER4 (0.79) PTGER4PTGER2PTGER3
SCHEMBL11067995 0.88 PTGER4 (0.79) PTGER4PTGER2PTGER3
SCHEMBL14268646 0.80 PTGER4 (0.76) PTGER4PTGER2PTGER3
SCHEMBL14464291 0.80 PTGER4 (0.72) PTGER4PTGER2PTGER3
SCHEMBL11662045 0.79 PTGER4 (0.77) PTGER4PTGER2PTGER3
SCHEMBL11830499 0.78 PTGER4 (1.00) PTGER4PTGER2PTGER3
SCHEMBL11830503 0.78 PTGER4 (1.00) PTGER4PTGER2PTGER3
SCHEMBL11062779 0.78 PTGER4 (0.41) PTGER4PTGER2PTGER3
SCHEMBL11062776 0.78 PTGER4 (0.41) PTGER4PTGER2PTGER3

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-4456613-A 6-Keto- and 6-hydroxy-8-azaprostanoids and anti-ulcer use thereof E. I. DU PONT DE NEMOURS AND COMPANY (US) 1984-06-26 — — US disclosed
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