SCHEMBL7764692

SCHEMBL7764692

c1ccc(-c2ccccc2-c2ccccc2Nc2ccc(N(c3ccc(Nc4ccccc4-c4ccccc4-c4ccccc4)cc3)c3ccc(Nc4ccccc4-c4ccccc4-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 1/20 0.40
MAPK12 P53778 1/20 0.40
MAPK11 Q15759 1/20 0.40
MAPK14 Q16539 1/20 0.40
FABP3 P05413 1/20 0.40
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
KDM1A O60341 1/20 0.38
KDM4E B2RXH2 4/20 0.37
MAPT P10636 4/20 0.37
TDP1 Q9NUW8 3/20 0.37
MEN1 O00255 2/20 0.37
GAA P10253 2/20 0.37
KMT2A Q03164 2/20 0.37
GLA P06280 1/20 0.37
RECQL P46063 1/20 0.37
AURKA O14965 1/20 0.36
ALDH1A1 P00352 6/20 0.36
CYP1A2 P05177 2/20 0.36
CYP2D6 P10635 2/20 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
SCHEMBL919631 0.93 FABP3 (0.46) MAPK13MAPK12MAPK11MAPK14FABP3
SCHEMBL16905782 0.90 FABP3 (0.44) MAPK13MAPK12MAPK11MAPK14FABP3
SCHEMBL20736551 0.88 FABP3 (0.42) MAPK13MAPK12MAPK11MAPK14FABP3
SCHEMBL19048837 0.88 FABP3 (0.42) MAPK13MAPK12MAPK11MAPK14FABP3
SCHEMBL12933993 0.86 FABP3 (0.40) MAPK13MAPK12MAPK11MAPK14FABP3
SCHEMBL23205456 0.85 FABP3 (0.44) MAPK13MAPK12MAPK11MAPK14FABP3
SCHEMBL30335092 0.85 FABP3 (0.44) MAPK13MAPK12MAPK11MAPK14FABP3
SCHEMBL26028608 0.85 FABP3 (0.44) MAPK13MAPK12MAPK11MAPK14FABP3
SCHEMBL16720876 0.85 MAPT (0.50) MAPK13MAPK12MAPK11MAPK14FABP3
SCHEMBL4098527 0.84 MAPT (0.42) MAPK13MAPK12MAPK11MAPK14FABP3

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
JP-2001172232-A ELECTROLUMINESCENT ELEMENT UNIV OSAKA 2001-06-26 JP disclosed