SCHEMBL9084549

SCHEMBL9084549

CCCCCCCCCCC(O)[C@H](O)CC[C@@H](O)[C@H]1CCC(=O)O1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 3/20 0.49
CYP1A2 P05177 2/20 0.47

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
SCHEMBL6859191 0.90 PRKCA (0.51) PRKCACYP1A2
SCHEMBL18193440 0.90 PRKCA (0.51) PRKCACYP1A2
SCHEMBL15603789 0.90 PRKCA (0.51) PRKCACYP1A2
SCHEMBL9431402 0.86 PRKCA (0.51) PRKCACYP1A2
SCHEMBL8765011 0.86 PRKCA (0.51) PRKCACYP1A2
SCHEMBL10532084 0.83
SCHEMBL10532101 0.83
SCHEMBL10919331 0.83
SCHEMBL3442326 0.82 PRKCA (0.45) PRKCACYP1A2
SCHEMBL25931772 0.79 CYP1A2 (0.54) PRKCACYP1A2

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-5587491-A Method for the synthesis of bis-tetrahydrofuranyl Annonaceous acetogenins REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1996-12-24 US disclosed