SCHEMBL9166845

SCHEMBL9166845

COCCCCC(C)(C)C(=O)CO[PH](=O)OCC(=O)C(C)(C)CCCCOC

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
ARG1 P05089 1/20 0.33
ARG2 P78540 1/20 0.33
CYP4F2 P78329 1/20 0.30
CYP4A11 Q02928 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
SCHEMBL9166849 0.89 ALDH1A1 (0.34) ALDH1A1ARG1ARG2
SCHEMBL9162912 0.81 CES2 (0.33) CYP4F2CYP4A11
SCHEMBL7951236 0.72 ALDH1A1 (0.37) ALDH1A1ARG1ARG2CYP4F2CYP4A11
SCHEMBL7952899 0.71 ALDH1A1 (0.36) ALDH1A1ARG1ARG2CYP4F2CYP4A11
SCHEMBL7947550 0.71 CYP4F2 (0.43) ALDH1A1ARG1ARG2CYP4F2CYP4A11
SCHEMBL9157108 0.70 ALDH1A1 (0.52) ALDH1A1
SCHEMBL9162916 0.69 CES2 (0.33) CYP4F2CYP4A11
SCHEMBL8933386 0.69 ALDH1A1 (0.41) ALDH1A1
SCHEMBL31053497 0.68 ALDH1A1 (0.39) ALDH1A1ARG1ARG2CYP4F2CYP4A11
SCHEMBL10543798 0.68

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-5380709-A Prostaglandins E and anti ulcers containing same K.K. UENO SEIYAKU OYO KENKYUJO (JP) 1995-01-10 US disclosed