SCHEMBL10032471

SCHEMBL10032471

Cc1ccc2cc(-c3c4ccccc4c(-c4cccc(-c5ccccn5)c4)c4ccccc34)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.44
MAPT P10636 3/20 0.42
LMNA P02545 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
IRAK4 Q9NWZ3 1/20 0.42
PKM P14618 4/20 0.41
TP53 P04637 3/20 0.41
KDM4E B2RXH2 3/20 0.41
NPC1 O15118 3/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HSD17B10 Q99714 2/20 0.41
RAB9A P51151 2/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TSHR P16473 1/20 0.40
KLF5 Q13887 1/20 0.40
METAP2 P50579 1/20 0.40

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
SCHEMBL10032884 0.96 GRM5 (0.43) GRM5MAPTLMNANPSR1L3MBTL1
SCHEMBL14506014 0.94 SMN1; SMN2 (0.45) GRM5MAPTLMNANPSR1L3MBTL1
SCHEMBL10032667 0.92 GRM5 (0.41) GRM5MAPTLMNANPSR1L3MBTL1
SCHEMBL10032878 0.90 IRAK4 (0.40) GRM5IRAK4PKMTP53KDM4E
SCHEMBL17227628 0.89 SMN1; SMN2 (0.50) MAPTLMNANPSR1L3MBTL1PKM
SCHEMBL10030072 0.87 GRM5 (0.44) GRM5MAPTLMNANPSR1L3MBTL1
SCHEMBL9887190 0.87 PKM (0.50) GRM5MAPTLMNANPSR1IRAK4
SCHEMBL10032672 0.86 DHODH (0.41) GRM5MAPTLMNANPSR1L3MBTL1
SCHEMBL10017233 0.86 DHODH (0.41) GRM5MAPTLMNANPSR1L3MBTL1
SCHEMBL13015317 0.86 DHODH (0.47) MAPTLMNANPSR1L3MBTL1PKM

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
WO-2012060374-A1 ELECTRON TRANSPORT MATERIAL AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING SAME JNC株式会社 (JP) 2012-05-10 WO disclosed