SCHEMBL8760520

SCHEMBL8760520

C=CCC(C(=O)O)=C(N)N

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
FGFR4 P22455 1/20 0.35
LDHA P00338 1/20 0.32
LDHB P07195 1/20 0.32
HTT P42858 1/20 0.31
LMNA P02545 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
SCHEMBL8570759 0.85 ALDH1A1 (0.35) ALDH1A1TSHRFGFR4LDHALDHB
SCHEMBL815175 0.84 LMNA (0.37) ALDH1A1TSHRLMNA
SCHEMBL815174 0.84 LMNA (0.37) ALDH1A1TSHRLMNA
SCHEMBL3903875 0.84 LMNA (0.37) ALDH1A1TSHRLMNA
SCHEMBL4562297 0.83 ALDH1A1 (0.33) ALDH1A1TSHRFGFR4LDHALDHB
SCHEMBL731667 0.83 ALDH1A1 (0.33) ALDH1A1TSHRFGFR4LDHALDHB
SCHEMBL6595665 0.81 GRIK1 (0.33) ALDH1A1TSHRFGFR4LMNA
SCHEMBL6595670 0.81 GRIK1 (0.33) ALDH1A1TSHRFGFR4LMNA
SCHEMBL4758053 0.79 LMNA (0.33) ALDH1A1TSHRLMNA
SCHEMBL1489417 0.78 ALDH1A1 (0.34) ALDH1A1TSHR

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
EP-0735065-B1 Amphoteric polymer dispersion, process for preparation and its use GIULINI CHEMIE (DE) 1997-05-28 EP claimed