SCHEMBL24947191

SCHEMBL24947191

Clc1cccc(-c2cc(-c3ccccc3)ccc2-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.41
PARP1 P09874 1/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
ALOX5 P09917 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
TDP2 O95551 1/20 0.38
SLC6A9 P48067 1/20 0.38
MAOB P27338 2/20 0.38
PGR P06401 3/20 0.38
MAP4K4 O95819 1/20 0.37
KDM4E B2RXH2 2/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
MCL1 Q07820 1/20 0.36
BAD Q92934 1/20 0.36

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
SCHEMBL12856725 0.90 ATM (0.41) MEN1KMT2ANPC1RAB9AMAOB
SCHEMBL12856754 0.90 ATM (0.41) MEN1KMT2ANPC1RAB9AMAOB
SCHEMBL27012163 0.88 CYP1A2 (0.46) PARP1NPC1RAB9ASLC6A9MAP4K4
SCHEMBL29892513 0.87 DNM1 (0.38) MEN1KMT2AMAP4K4KDM4ELMNA
SCHEMBL29104448 0.87 DNM1 (0.38) MEN1KMT2AMAP4K4KDM4ELMNA
SCHEMBL30257199 0.87 DNM1 (0.38) MEN1KMT2AMAP4K4KDM4ELMNA
SCHEMBL24948974 0.87 MCL1 (0.39) TAAR1PARP1MEN1GAAKMT2A
SCHEMBL21165689 0.86 L3MBTL1 (0.44) MEN1KMT2AALOX5NPC1RAB9A
SCHEMBL20865079 0.85 ATM (0.42) MEN1KMT2ANPC1RAB9AMAOB
SCHEMBL21420744 0.85 PARP1 (0.42) PARP1MEN1GAAKMT2ANPC1

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
WO-2023002447-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed
WO-2023003403-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed