SCHEMBL22136116

SCHEMBL22136116

c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccc6ccc7cnccc7c6c5)cc5c4sc4ccccc45)nc(-c4ccccc4)n3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 3/20 0.38
MAPT P10636 4/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
NTSR1 P30989 1/20 0.34
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
CYP19A1 P11511 1/20 0.33
DHODH Q02127 3/20 0.33
LIMK1 P53667 1/20 0.32
PIM3 Q86V86 1/20 0.32
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
ALOX5 P09917 1/20 0.32
ROCK1 Q13464 1/20 0.31
PRKCZ Q05513 1/20 0.31
PRKD2 Q9BZL6 1/20 0.31

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
SCHEMBL22135989 0.91 MAPK10 (0.40) MAPK10MAPTLMNALIMK1PIM3
SCHEMBL22136051 0.90 MAPK10 (0.39) MAPK10MAPTALDH1A1MEN1KMT2A
SCHEMBL22136196 0.90 MAPK10 (0.39) MAPK10MAPTALDH1A1HPGDKDM4E
SCHEMBL22136100 0.87 MAPK10 (0.37) MAPK10MAPTLMNALIMK1PIM3
SCHEMBL22136322 0.86 LIMK1 (0.35) MAPK10MAPTALDH1A1HPGDKDM4E
SCHEMBL23730938 0.85 MEN1 (0.47) MAPTALDH1A1HPGDKDM4EMEN1
SCHEMBL22136327 0.84 MAPK10 (0.38) MAPK10MAPTALDH1A1HPGDKDM4E
SCHEMBL22136189 0.84 MAPK10 (0.37) MAPK10MAPTALDH1A1HPGDKDM4E
SCHEMBL22136120 0.83 MAPK10 (0.46) MAPK10MAPTALDH1A1HPGDKDM4E
SCHEMBL22136115 0.82 TOP1 (0.36) MAPK10MAPTALDH1A1HPGDKDM4E

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