SCHEMBL8887154

SCHEMBL8887154

CCC(C)(C)OOC(C)(C)CN1C(=O)C(C)=C(C)C1=O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.35
WRN Q14191 1/20 0.35
ALDH1A1 P00352 2/20 0.33
PKM P14618 1/20 0.33
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL8888743 0.86 BLM (0.36) BLMWRNALDH1A1PKMTSHR
SCHEMBL8889321 0.85 BLM (0.33) BLMWRNALDH1A1PKM
SCHEMBL8888038 0.84 ALDH1A1 (0.33) BLMWRNALDH1A1TSHRTDP1
SCHEMBL8889200 0.81 ALDH1A1 (0.39) ALDH1A1PKM
SCHEMBL8888387 0.79 ALDH1A1 (0.37) ALDH1A1PKM
SCHEMBL8888509 0.78 FOS (0.30)
SCHEMBL8889507 0.77 MGLL (0.45) BLMWRNALDH1A1PKMTSHR
SCHEMBL8888336 0.76 ALDH1A1 (0.35) ALDH1A1PKM
SCHEMBL8889089 0.75 ALDH1A1 (0.30) ALDH1A1PKM
SCHEMBL8889102 0.75 MAPK1 (0.52) ALDH1A1PKM

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
WO-1997003961-A1 IMIDO PEROXIDES AS INITIATORS OF POLYMERIZATION PROCESSES AKZO NOBEL N.V. (NL) 1997-02-06 WO disclosed