SCHEMBL12467388

SCHEMBL12467388

CCCCSc1ccc(-c2nc(-c3ccc(Br)cc3)nc(-c3ccc(Br)cc3)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
TP53 P04637 1/20 0.47
XDH P47989 1/20 0.46
MAOA P21397 2/20 0.43
MAOB P27338 1/20 0.43
SLC2A1 P11166 1/20 0.42
NPC1 O15118 4/20 0.40
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP2C9 P11712 1/20 0.40
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
NFKB1 P19838 1/20 0.38
MAPK1 P28482 1/20 0.38
NFKB2 Q00653 1/20 0.38

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
SCHEMBL3369604 0.86 MAOA (0.53) MAPTTP53XDHMAOAMAOB
SCHEMBL13592798 0.84 MAOA (0.46) MAPTTP53XDHMAOAMAOB
SCHEMBL9100085 0.81 MAPT (0.51) MAPTTP53MAOAMAOBSLC2A1
SCHEMBL9361405 0.79 TP53 (0.50) MAPTTP53MAOAMAOBSLC2A1
SCHEMBL3842009 0.79 TP53 (0.50) MAPTTP53MAOAMAOBSLC2A1
SCHEMBL7928406 0.79 TP53 (0.50) MAPTTP53MAOAMAOBSLC2A1
SCHEMBL10528156 0.79 TP53 (0.50) MAPTTP53MAOAMAOBSLC2A1
SCHEMBL9096083 0.79 TP53 (0.50) MAPTTP53MAOAMAOBSLC2A1
SCHEMBL10525993 0.78 SLC2A1 (0.62) MAPTXDHMAOAMAOBSLC2A1
SCHEMBL5887468 0.76 MAOA (0.62) MAPTXDHMAOAMAOBSLC2A1

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-7985815-B2 Polymer, its preparation and uses CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2011-07-26 US disclosed
EP-2166582-A1 Conjugated copolymer comprising triazine, its preparation and uses Cambridge Display Technology Limited (GB) 2010-03-24 EP disclosed