SCHEMBL20016625

SCHEMBL20016625

CCOC(C)(C)CC(C)(C)CC(C)(C)C(C)=O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 1/20 0.33

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
SCHEMBL19400061 0.81
SCHEMBL9294282 0.80 GAA (0.40) ALDH1A1LMNAHSD17B10GAA
SCHEMBL536285 0.80 ALDH1A1 (0.32) ALDH1A1
SCHEMBL21160100 0.74 GAA (0.31) GAA
SCHEMBL18084166 0.73 GAA (0.36) ALDH1A1LMNAHSD17B10GAA
SCHEMBL1149368 0.73
SCHEMBL10999225 0.71 ALDH1A1 (0.39) ALDH1A1LMNAHSD17B10GAA
SCHEMBL14420197 0.70 GAA (0.38) ALDH1A1LMNAHSD17B10GAA
SCHEMBL19275048 0.70 GAA (0.48) GAA
SCHEMBL27339480 0.70 GAA (0.33) ALDH1A1LMNAGAA

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-9931420-B2 Methods of making DLL3 antibody drug conjugates ABBVIE STEMCENTRX LLC (US) 2018-04-03 US disclosed