SCHEMBL484040

SCHEMBL484040

CCC(C(=O)O)N1C(=O)C(CO)(c2cc3ccoc3cc2O)c2ccccc21

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CBX7 O95931 1/20 0.33
CDYL2 Q8N8U2 1/20 0.33
CDYL Q9Y232 1/20 0.33
CDY1; CDY1B Q9Y6F8 1/20 0.33
GAA P10253 1/20 0.33
SCN9A Q15858 1/20 0.33
GLI1 P08151 1/20 0.31
CTNNB1 P35222 1/20 0.31
WNT3A P56704 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
PTGES O14684 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
SCHEMBL281522 0.82 SCN9A (0.33) CBX7CDYL2CDYLCDY1; CDY1BSCN9A
SCHEMBL281082 0.81 SCN9A (0.47) GAASCN9AALDH1A1
SCHEMBL281452 0.80 CDYL (0.36) CBX7CDYL2CDYLCDY1; CDY1BGAA
SCHEMBL4168033 0.78 SCN9A (0.55) GAASCN9AALDH1A1
SCHEMBL484021 0.74 TRPA1 (0.42) GAAALDH1A1
SCHEMBL281912 0.71
SCHEMBL281679 0.68 PTGDR2 (0.36) GAASCN9ALMNA
SCHEMBL281957 0.68 ALDH1A1 (0.31) SCN9AALDH1A1
SCHEMBL282052 0.68 FABP4 (0.37) SCN9AALDH1A1
SCHEMBL281967 0.68 ALDH1A1 (0.37) CBX7CDYL2CDYLCDY1; CDY1BSCN9A

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-1888595-B1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USES AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2012-02-01 EP disclosed