SCHEMBL23181555

SCHEMBL23181555

C1=CC(c2cc(-c3ccc4nc5cc(-c6cc(-c7ccccc7)nc(-c7ccccc7)c6)ccc5nc4c3)cc(-c3ccccc3)n2)=CCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 1/20 0.35
PIK3CA P42336 1/20 0.35
MEN1 O00255 5/20 0.34
KMT2A Q03164 5/20 0.34
CYP19A1 P11511 1/20 0.34
MAPT P10636 3/20 0.33
AGTR1 P30556 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
ADORA2A P29274 2/20 0.32
ADORA1 P30542 2/20 0.32
KDM4E B2RXH2 2/20 0.32
MCL1 Q07820 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
NTSR1 P30989 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
RAB9A P51151 1/20 0.32
MYC P01106 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
SCHEMBL26033261 0.85 CYP19A1 (0.41) MEN1KMT2ACYP19A1MAPTAGTR1
SCHEMBL23181566 0.83
SCHEMBL25663849 0.82 MEN1 (0.33) MEN1KMT2ACYP19A1MAPTAGTR1
SCHEMBL23181683 0.81 PIK3R1 (0.47) PIK3R1PIK3CAMEN1KMT2ACYP19A1
SCHEMBL23479088 0.81 KDM4E (0.46) PIK3CAMEN1KMT2AMAPTTDP1
SCHEMBL20125555 0.79 AGTR1 (0.41) MEN1KMT2AMAPTAGTR1TDP1
SCHEMBL15871198 0.79 MEN1 (0.43) MEN1KMT2AMAPTAGTR1TDP1
SCHEMBL23181340 0.79 AGTR1 (0.41) MEN1KMT2AMAPTAGTR1TDP1
SCHEMBL25985410 0.78 MCL1 (0.46) MEN1KMT2AMAPTTDP1KDM4E
SCHEMBL21665132 0.78 KDM4E (0.34) MEN1KMT2ACYP19A1MAPTADORA1

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-2021057009-A1 N-HETEROCYCLIC PLANAR OPTICAL COUPLING OUTPUT MATERIAL AND PREPARATION METHOD THEREFOR 武汉华星光电半导体显示技术有限公司 2021-04-01 WO disclosed