SCHEMBL31298567

SCHEMBL31298567

NC(=O)C=CNC=CC(N)=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.37
ALDH1A1 P00352 3/20 0.37
FGFR4 P22455 1/20 0.37
LMNA P02545 3/20 0.32
NFKB1 P19838 2/20 0.32
CYP1A2 P05177 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
THPO P40225 1/20 0.32
CA2 P00918 1/20 0.32
CYP3A4 P08684 1/20 0.32
CA5A P35218 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
CA9 Q16790 1/20 0.32
OR51E2 Q9H255 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
DDAH1 O94760 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31

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
Ammonia Solution, Strong SCHEMBL10432434 0.97 TSHR (0.35) TSHRALDH1A1FGFR4LMNANFKB1
SCHEMBL3071102 0.78
SCHEMBL3071101 0.78
SCHEMBL3083702 0.75
SCHEMBL15885990 0.75
SCHEMBL24637800 0.75
SCHEMBL3083701 0.75
SCHEMBL2031717 0.75
SCHEMBL156118 0.73
SCHEMBL156117 0.73

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-2024238900-A1 METHODS OF REDUCING MISLOCALIZATION OF AN ANALYTE 10X GENOMICS, INC. (US) 2024-11-21 WO disclosed