SCHEMBL6852920

SCHEMBL6852920

C=CC(NCC=O)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL3427694 1.00 CTSK (0.33) CTSKSMN1; SMN2
SCHEMBL1517802 0.80 MAPT (0.32) SMN1; SMN2
SCHEMBL1730363 0.80 MAPT (0.32) SMN1; SMN2
SCHEMBL613872 0.80 MAPT (0.32) SMN1; SMN2
SCHEMBL1121020 0.79 CA12 (0.40) SMN1; SMN2
SCHEMBL7505723 0.77 CA12 (0.36) CTSK
SCHEMBL17162508 0.77 DGAT1 (0.33) CTSKSMN1; SMN2
SCHEMBL29548346 0.74 CA1 (0.42) CTSKSMN1; SMN2
SCHEMBL30645415 0.73 ITGA4 (0.36) CTSKSMN1; SMN2
SCHEMBL7424429 0.69 CA12 (0.35) CTSKSMN1; SMN2

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-6787612-B1 PRODUCING SUCH AS HYDRAZYL-CARBONYL-AMINO METHYLATED POLYSTYRENE; MINIMIZES SOLUTION-PHASE SYNTHETIC STEPS IN SOLID-PHASE PEPTIDE OR PEPTIDE ANALOG SYNTHESIS DENDREON CORPORATION 2004-09-07 US disclosed