SCHEMBL22136189

SCHEMBL22136189

c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccc6ncc7ccccc7c6c5)cc5c4sc4ccccc45)nc(-c4ccccc4)n3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 1/20 0.37
MAPT P10636 4/20 0.36
LMNA P02545 2/20 0.36
NPC1 O15118 1/20 0.36
RECQL P46063 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LIMK1 P53667 1/20 0.35
KDM4E B2RXH2 2/20 0.35
GPR3 P46089 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
NTSR1 P30989 1/20 0.35
PIK3CA P42336 3/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CB P42338 1/20 0.35
MTOR P42345 1/20 0.35
PIK3CG P48736 1/20 0.35

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
SCHEMBL22136120 0.93 MAPK10 (0.46) MAPK10MAPTLMNANPC1RECQL
SCHEMBL22136322 0.92 LIMK1 (0.35) MAPK10MAPTLMNANPC1RAB9A
SCHEMBL22135990 0.91 MAPK10 (0.39) MAPK10MAPTLMNANPC1RECQL
SCHEMBL22136063 0.89 MAPT (0.39) MAPK10MAPTLMNANPC1RECQL
SCHEMBL22136332 0.89 MAPT (0.39) MAPK10MAPTLMNANPC1RECQL
SCHEMBL23730938 0.87 MEN1 (0.47) MAPTLMNALIMK1KDM4EMEN1
SCHEMBL22136097 0.87 ALOX5 (0.38) MAPK10MAPTLMNANPC1RECQL
SCHEMBL22136327 0.86 MAPK10 (0.38) MAPK10MAPTLMNANPC1RECQL
SCHEMBL22136116 0.84 MAPK10 (0.38) MAPK10MAPTLMNALIMK1KDM4E
SCHEMBL23730845 0.83 MEN1 (0.44) MAPTLMNALIMK1KDM4EMEN1

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-2020130553-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 두산솔루스 주식회사 2020-06-25 WO disclosed