SCHEMBL28301059

SCHEMBL28301059

Ic1ccc(-c2ccc3c(c2-c2ccc(I)cc2)Cc2ccccc2O3)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
MAPKAPK2 P49137 1/20 0.35
NPC1 O15118 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
GAA P10253 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL28588455 0.88 MAOA (0.50) MAOAMAOBMAPKAPK2NPC1LMNA
Ammonia Solution, Strong SCHEMBL21753905 0.84 MAOA (0.43) MAOAMAOBMAPKAPK2NPC1LMNA
SCHEMBL28299306 0.84 MAOA (0.48) MAOAMAOBMAPKAPK2NPC1LMNA
SCHEMBL11781450 0.72 MAOA (0.48) MAOAMAOBMAPKAPK2NPC1LMNA
SCHEMBL27896055 0.72 MAOA (0.48) MAOAMAOBMAPKAPK2NPC1LMNA
SCHEMBL8655485 0.72 MAOA (0.48) MAOAMAOBMAPKAPK2NPC1LMNA
SCHEMBL31447550 0.72 MAOA (0.48) MAOAMAOBMAPKAPK2NPC1LMNA
SCHEMBL149766 0.70 MAOA (0.55) MAOAMAOBMAPKAPK2
SCHEMBL30859067 0.70 MAOA (0.55) MAOAMAOBMAPKAPK2
SCHEMBL11506362 0.70 MAOA (0.46) MAOAMAOBMAPKAPK2GAA

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
CN-109824889-A The Nomex of structure containing xanthene and its method are prepared based on diiodo- xanthene compound 江西师范大学 2019-05-31 CN disclosed
CN-109824889-A The Nomex of structure containing xanthene and its method are prepared based on diiodo- xanthene compound 江西师范大学 2019-05-31 CN disclosed