SCHEMBL266828

SCHEMBL266828

O=C(Nc1ccc(Br)cc1C(=O)NN=Cc1cccc(F)c1)c1ccno1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
MEN1 O00255 7/20 0.46
KMT2A Q03164 7/20 0.46
NPC1 O15118 4/20 0.46
RAB9A P51151 3/20 0.46
SLC34A2 O95436 1/20 0.46
SLC34A1 Q06495 1/20 0.46
SLC34A3 Q8N130 1/20 0.46
SLC20A1 Q8WUM9 1/20 0.46
TDP1 Q9NUW8 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
POLB P06746 3/20 0.45
PLEC Q15149 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
OPRK1 P41145 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44

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
SCHEMBL273719 1.00 GAA (0.48) GAAMGAMSIMGAM2MEN1
SCHEMBL274298 0.90 RAB9A (0.54) GAAMGAMSIMGAM2MEN1
SCHEMBL266761 0.90 RAB9A (0.54) GAAMGAMSIMGAM2MEN1
SCHEMBL273869 0.86 NPC1 (0.60) GAAMGAMSIMGAM2MEN1
SCHEMBL265031 0.86 NPC1 (0.60) GAAMGAMSIMGAM2MEN1
SCHEMBL267441 0.85 GAA (0.47) GAAMEN1KMT2ANPC1RAB9A
SCHEMBL273872 0.85 GAA (0.47) GAAMEN1KMT2ANPC1RAB9A
SCHEMBL269054 0.85 CYP2D6 (0.55) GAAMGAMSIMGAM2MEN1
SCHEMBL269055 0.85 CYP2D6 (0.55) GAAMGAMSIMGAM2MEN1
SCHEMBL268120 0.85 MEN1 (0.51) GAAMGAMSIMGAM2MEN1

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
US-8134015-B2 Compound inhibiting in vivo phosphorous transport and medicine containing the same KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-03-13 US disclosed