SCHEMBL27797665

SCHEMBL27797665

CCOC1(COC(=O)C(C)(C)C)CCNCC1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.35
PRKCA P17252 9/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
PRKCE Q02156 2/20 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
SCHEMBL27776772 0.84 SMN1; SMN2 (0.33) OPRM1PRKCASMN1; SMN2PRKCE
SCHEMBL27721987 0.77 SMN1; SMN2 (0.37) OPRM1PRKCASMN1; SMN2
SCHEMBL28283764 0.76 SMN1; SMN2 (0.34) OPRM1PRKCASMN1; SMN2PRKCE
SCHEMBL27778608 0.76 SMN1; SMN2 (0.34) OPRM1PRKCASMN1; SMN2
SCHEMBL28023211 0.75 OPRM1 (0.33) OPRM1
SCHEMBL28000343 0.73 SMN1; SMN2 (0.33) OPRM1PRKCASMN1; SMN2PRKCE
SCHEMBL28232892 0.72 PRKCA (0.33) PRKCASMN1; SMN2
SCHEMBL28680025 0.70 PRKCA (0.33) PRKCASMN1; SMN2PRKCE
SCHEMBL28106912 0.69 KDM4E (0.33)
SCHEMBL13811598 0.66 SMN1; SMN2 (0.41) PRKCASMN1; SMN2PRKCE

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
CN-101687012-A New cyclic peptide compounds ASTELLAS PHARMA INC 2010-03-31 CN disclosed