SCHEMBL16418446

SCHEMBL16418446

Cc1sc2cc(-c3ccc(C(=C(c4ccccc4)c4ccccc4)c4ccccc4)cc3)ccc2[n+]1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SNCA P37840 3/20 0.39
▸ APP P05067 2/20 0.39
▸ TNF P01375 1/20 0.39
▸ NOD1 Q9Y239 1/20 0.39
▸ POLB P06746 2/20 0.38
▸ BCHE P06276 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MAPT P10636 6/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ HTT P42858 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ CTDSP1 Q9GZU7 1/20 0.33
▸ PIK3CG P48736 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ TSHR P16473 1/20 0.32

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
SCHEMBL6658511 0.88 KDM4E (0.42) SNCAAPPTNFNOD1POLB
SCHEMBL12301906 0.71 PIK3CA (0.37) SNCAAPPTNFNOD1POLB
SCHEMBL16418445 0.71 NPC1 (0.54) MEN1NPC1RAB9AKMT2AMAPT
SCHEMBL11515558 0.70 MAPT (0.58) SNCAAPPTNFNOD1POLB
SCHEMBL2451378 0.69 RAB9A (0.52) SNCAMEN1NPC1RAB9AKMT2A
Iodide SCHEMBL31063723 0.69 MAPT (0.61) SNCAAPPTNFNOD1POLB
SCHEMBL839316 0.67 MAPT (0.52) SNCAPOLBNPC1RAB9AMAPT
SCHEMBL30411778 0.67 MAPT (0.52) SNCAPOLBNPC1RAB9AMAPT
SCHEMBL11516326 0.67 MAPT (0.45) SNCAAPPTNFNOD1POLB
SCHEMBL14182250 0.67 NPC1 (0.57) POLBMEN1NPC1RAB9AKMT2A

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
US-9279806-B2 Water-soluble AIE luminogens for monitoring and retardation of fibrillation of amyloid proteins THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-03-08 — — US disclosed
US-20150031607-A1 WATER-SOLUBLE AIE LUMINOGENS FOR MONITORING AND RETARDATION OF FIBRILLATION OF AMYLOID PROTEINS THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2015-01-29 — — US disclosed
Send feedback