SCHEMBL265031

SCHEMBL265031

O=C(Nc1ccc(Br)cc1C(=O)NN=Cc1cccc(F)c1)c1ccco1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.60
KMT2A Q03164 4/20 0.60
MEN1 O00255 3/20 0.60
PKM P14618 3/20 0.60
KDM4E B2RXH2 7/20 0.50
ALDH1A1 P00352 4/20 0.50
MAPT P10636 4/20 0.50
RAB9A P51151 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
GAA P10253 3/20 0.50
HPGD P15428 3/20 0.50
TDP1 Q9NUW8 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
HTT P42858 2/20 0.50
TUBB8B A6NNZ2 1/20 0.50
EGFR P00533 1/20 0.50
TUBB4A P04350 1/20 0.50
TUBB P07437 1/20 0.50
TUBA3C P0DPH7 1/20 0.50
TUBA1B P68363 1/20 0.50

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
SCHEMBL273869 1.00 NPC1 (0.60) NPC1KMT2AMEN1PKMKDM4E
SCHEMBL273626 0.90 KMT2A (0.62) NPC1KMT2AMEN1PKMKDM4E
SCHEMBL266792 0.90 KMT2A (0.62) NPC1KMT2AMEN1PKMKDM4E
SCHEMBL273256 0.89 NPC1 (0.60) NPC1KMT2AMEN1PKMKDM4E
SCHEMBL268158 0.89 NPC1 (0.60) NPC1KMT2AMEN1PKMKDM4E
SCHEMBL266828 0.86 GAA (0.48) NPC1KMT2AMEN1PKMKDM4E
SCHEMBL273719 0.86 GAA (0.48) NPC1KMT2AMEN1PKMKDM4E
SCHEMBL273286 0.85 NPC1 (0.58) NPC1KMT2AMEN1PKMKDM4E
SCHEMBL268693 0.85 NPC1 (0.58) NPC1KMT2AMEN1PKMKDM4E
SCHEMBL266600 0.84 NPC1 (0.67) NPC1KMT2AMEN1PKMKDM4E

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