SCHEMBL30864320

SCHEMBL30864320

CC(=O)OC=C(C)C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
BLM P54132 1/20 0.35
PMP22 Q01453 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL30580709 0.78 LMNA (0.39) LMNAALOX15BLMPMP22TDP1
SCHEMBL27425799 0.77 ALDH1A1 (0.32) ALOX15TDP1ALDH1A1
SCHEMBL222854 0.76
SCHEMBL222855 0.76
SCHEMBL3414053 0.76 PTGS1 (0.34) ALDH1A1TSHR
SCHEMBL503438 0.76 PTGS1 (0.34) ALDH1A1TSHR
SCHEMBL562094 0.75 MGAM (0.44)
SCHEMBL21077581 0.72
SCHEMBL28702800 0.72 ALDH1A1 (0.43) ALDH1A1TSHR
SCHEMBL15809318 0.72 ALDH1A1 (0.43) TDP1ALDH1A1TSHR

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-117964824-B Multiple stimulus responsive homopolymer and preparation method and application thereof 天津师范大学 2024-05-28 CN disclosed