SCHEMBL26522757

SCHEMBL26522757

Clc1cccc(-c2ccccc2-c2ccc3c(c2)n2c4ccccc4c4ccc5c6ccccc6n3c5c42)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
PARP1 P09874 1/20 0.35
MCL1 Q07820 1/20 0.35
BAD Q92934 1/20 0.35
GAA P10253 1/20 0.35
TP53 P04637 1/20 0.34
PGR P06401 3/20 0.34
NUDT1 P36639 1/20 0.34

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
SCHEMBL26522612 0.92 MAOB (0.43) MAOAMAOBL3MBTL1KMT2AMEN1
SCHEMBL26522753 0.92 MAOA (0.43) MAOAMAOBL3MBTL1KMT2AMEN1
SCHEMBL26523009 0.86 NPC1 (0.38) MAOAMAOBL3MBTL1NPC1RAB9A
SCHEMBL26522758 0.85 HPGD (0.37) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL26522604 0.85 PAK1 (0.39) MAOBKMT2AMEN1KDM4EALDH1A1
SCHEMBL26522746 0.83 DNM1 (0.41) MAOAMAOBNPC1RAB9AKMT2A
SCHEMBL26522605 0.81 DNM1 (0.41) L3MBTL1NPC1RAB9AKMT2AMEN1
SCHEMBL26522500 0.81 DNM1 (0.41) L3MBTL1NPC1RAB9AKMT2AMEN1
SCHEMBL26522745 0.80 CYP2A6 (0.40) MAOBKMT2AMEN1KDM4EALDH1A1
SCHEMBL15434835 0.79 RXRA (0.41) MAOBL3MBTL1KMT2AMEN1KDM4E

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-2023185039-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC APPARATUS COMPRISING SAME 陕西莱特光电材料股份有限公司 2023-10-05 WO disclosed