SCHEMBL3974115

SCHEMBL3974115

COC(=O)c1ccc2c(c1)c(C(=O)O)cn2-c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 2/20 0.63
FGFR1 P11362 2/20 0.56
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 4/20 0.51
LMNA P02545 1/20 0.51
SCN2B O60939 1/20 0.49
SCN1A P35498 1/20 0.49
SCN1B Q07699 1/20 0.49
SCN5A Q14524 1/20 0.49
SCN9A Q15858 1/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HPGD P15428 2/20 0.46
GLA P06280 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.43
RORC P51449 3/20 0.43
MTNR1A P48039 1/20 0.43

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
SCHEMBL3972983 0.82 FGFR1 (0.54) NR4A2FGFR1ALDH1A1KDM4ELMNA
SCHEMBL3967405 0.80 MTNR1A (0.55) NR4A2FGFR1NPC1MTNR1AMTNR1B
SCHEMBL3970720 0.79 PLA2G4A (0.61) MTNR1AMTNR1B
SCHEMBL3969149 0.79 MTNR1A (0.54) NR4A2FGFR1SCN9AMTNR1AMTNR1B
Hydrochloric Acid SCHEMBL3969364 0.78 MTNR1A (0.53) NR4A2FGFR1SCN9AMTNR1AMTNR1B
SCHEMBL408819 0.77 NR4A2 (1.00) NR4A2ALDH1A1KDM4ELMNAMEN1
SCHEMBL13883856 0.77 MTNR1A (0.53) NR4A2FGFR1MTNR1AMTNR1B
SCHEMBL3973576 0.77 MAPT (0.50) NR4A2FGFR1ALDH1A1KDM4ELMNA
SCHEMBL3972972 0.77 MTNR1A (0.52) NR4A2FGFR1MTNR1AMTNR1B
SCHEMBL13883742 0.77 MAPT (0.50) NR4A2FGFR1ALDH1A1KDM4ELMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009047240-A1 INDOLE DERIVATIVES USEFUL AS PPAR ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2009-04-16 WO disclosed
WO-2009047240-A1 INDOLE DERIVATIVES USEFUL AS PPAR ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2009-04-16 WO disclosed