SCHEMBL16066476

SCHEMBL16066476

Fc1ccc(-c2cc(-c3ccc(F)cc3)nc(-n3c4ccccc4c4ccc5c(c6ccccc6n6c7ccccc7nc56)c43)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
HPGD P15428 5/20 0.48
KMT2A Q03164 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
CYP19A1 P11511 1/20 0.38
KDM4E B2RXH2 5/20 0.38
MAPT P10636 5/20 0.38
HSD17B10 Q99714 2/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
FLT3 P36888 2/20 0.36
BCL2 P10415 1/20 0.35
BMX P51813 1/20 0.35
MEN1 O00255 3/20 0.35
CYP1A2 P05177 2/20 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
SCHEMBL16066530 0.92 HPGD (0.43) ALDH1A1HPGDKMT2ASMN1; SMN2KDM4E
SCHEMBL16066375 0.92 HPGD (0.45) ALDH1A1HPGDKMT2ASMN1; SMN2KDM4E
SCHEMBL16066667 0.91 ALDH1A1 (0.47) ALDH1A1HPGDKMT2ASMN1; SMN2CYP19A1
SCHEMBL16066794 0.89 ALDH1A1 (0.49) ALDH1A1HPGDKMT2ASMN1; SMN2CYP19A1
SCHEMBL16066176 0.89 ALDH1A1 (0.51) ALDH1A1HPGDKMT2ASMN1; SMN2CYP19A1
SCHEMBL16066482 0.88 MAPT (0.39) ALDH1A1HPGDKMT2ASMN1; SMN2KDM4E
SCHEMBL16066481 0.88 DHODH (0.39) ALDH1A1HPGDKMT2ASMN1; SMN2KDM4E
SCHEMBL16066602 0.86 ALDH1A1 (0.48) ALDH1A1HPGDKMT2ASMN1; SMN2CYP19A1
SCHEMBL16066417 0.86 KDM4E (0.42) ALDH1A1HPGDKMT2ASMN1; SMN2KDM4E
SCHEMBL16066181 0.84 HPGD (0.43) ALDH1A1HPGDKMT2ASMN1; SMN2KDM4E

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-2014142488-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING SAME 주식회사 두산 (KR) 2014-09-18 WO disclosed