SCHEMBL11664455

SCHEMBL11664455

CCCCCC(O)/C=C/C1CCC(=O)N1CCC(C)CCCC(=O)O

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 19/20 0.79
▸ PTGER3 P43115 11/20 0.79
▸ PTGER2 P43116 11/20 0.79
▸ KCNH2 Q12809 1/20 0.53

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
SCHEMBL11662045 0.89 PTGER4 (0.77) PTGER4PTGER3PTGER2KCNH2
SCHEMBL11830503 0.89 PTGER4 (1.00) PTGER4PTGER3PTGER2
SCHEMBL11830499 0.89 PTGER4 (1.00) PTGER4PTGER3PTGER2
SCHEMBL11666056 0.88 PTGER4 (0.62) PTGER4PTGER3PTGER2KCNH2
SCHEMBL5183543 0.85 PTGER4 (1.00) PTGER4PTGER3PTGER2
SCHEMBL2446210 0.85 PTGER4 (1.00) PTGER4PTGER3PTGER2
SCHEMBL2446214 0.85 PTGER4 (1.00) PTGER4PTGER3PTGER2
SCHEMBL2446235 0.85 PTGER4 (1.00) PTGER4PTGER3PTGER2
SCHEMBL5214403 0.84 PTGER4 (0.94) PTGER4PTGER3PTGER2
SCHEMBL5216101 0.84 PTGER4 (0.76) PTGER4PTGER3PTGER2

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-4115401-A RESPIRATORY DISORDERS LABAZ (FR) 1978-09-19 — — US claimed
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