SCHEMBL22136115

SCHEMBL22136115

c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccc6ccc7cccnc7c6c5)cc5c4sc4ccccc45)nc(-c4ccccc4)n3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 6/20 0.36
LIMK1 P53667 2/20 0.36
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 2/20 0.34
HPGD P15428 2/20 0.34
NTSR1 P30989 1/20 0.34
ROCK1 Q13464 1/20 0.33
KDM4E B2RXH2 2/20 0.32
LMNA P02545 2/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
PIM3 Q86V86 2/20 0.32
TNKS O95271 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
SCHEMBL22135984 0.91 LIMK1 (0.38) TOP1LIMK1ALDH1A1MEN1KMT2A
SCHEMBL22136113 0.90 LIMK1 (0.37) TOP1LIMK1ALDH1A1MEN1KMT2A
SCHEMBL22136064 0.90 LIMK1 (0.37) TOP1LIMK1ALDH1A1MEN1KMT2A
SCHEMBL22136327 0.88 MAPK10 (0.38) TOP1LIMK1ALDH1A1MEN1KMT2A
SCHEMBL22136098 0.87 ALOX5 (0.37) LIMK1ALDH1A1MEN1KMT2AMAPT
SCHEMBL22136082 0.86 TOP1 (0.36) TOP1LIMK1ALDH1A1MEN1KMT2A
SCHEMBL23730938 0.85 MEN1 (0.47) LIMK1ALDH1A1MEN1KMT2AMAPT
SCHEMBL22136120 0.83 MAPK10 (0.46) ALDH1A1MEN1KMT2AMAPTHPGD
SCHEMBL22136116 0.82 MAPK10 (0.38) LIMK1ALDH1A1MEN1KMT2AMAPT
SCHEMBL22136322 0.82 LIMK1 (0.35) LIMK1ALDH1A1MEN1KMT2AMAPT

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