SCHEMBL11835583

SCHEMBL11835583

CCCCCC(=O)C=CC1CCC(=O)N1CCCCCCC(=O)O

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 20/20 0.71
PTGER3 P43115 14/20 0.71
PTGER2 P43116 10/20 0.71
KCNH2 Q12809 1/20 0.56
PTGER1 P34995 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
SCHEMBL4377087 0.93 PTGER4 (0.62) PTGER4PTGER3PTGER2KCNH2
SCHEMBL4377089 0.93 PTGER4 (0.62) PTGER4PTGER3PTGER2KCNH2
SCHEMBL4377090 0.93 PTGER4 (0.62) PTGER4PTGER3PTGER2KCNH2
SCHEMBL4377952 0.93 PTGER4 (0.62) PTGER4PTGER3PTGER2KCNH2
SCHEMBL5762456 0.92 PTGER4 (0.61) PTGER4PTGER3PTGER2KCNH2
SCHEMBL6803068 0.91 PTGER4 (0.60) PTGER4PTGER3PTGER2KCNH2
SCHEMBL6803076 0.91 PTGER4 (0.60) PTGER4PTGER3PTGER2KCNH2
SCHEMBL7245447 0.88 PTGER4 (0.72) PTGER4PTGER3PTGER2
SCHEMBL7245443 0.88 PTGER4 (0.72) PTGER4PTGER3PTGER2
SCHEMBL5250941 0.87 PTGER4 (0.56) PTGER4PTGER3PTGER2KCNH2

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-3975399-A PROSTAGLANDIN LIKE ACTIVITY E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-08-17 US claimed