SCHEMBL16066414

SCHEMBL16066414

c1cc(-c2ccncc2)cc(-n2c3ccccc3c3ccc4c(c5ccccc5n5c6ccccc6nc45)c32)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 4/20 0.39
BCL2 P10415 1/20 0.38
KMT2A Q03164 8/20 0.37
MAPT P10636 6/20 0.37
MEN1 O00255 6/20 0.37
CYP1A2 P05177 2/20 0.37
CAMKK1 Q8N5S9 2/20 0.37
CAMKK2 Q96RR4 2/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CASP1 P29466 1/20 0.37
CYP2C19 P33261 1/20 0.37
CASP7 P55210 1/20 0.37
NPC1 O15118 1/20 0.36
CYP3A4 P08684 1/20 0.36
RAB9A P51151 1/20 0.36
POLB P06746 2/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL16066376 0.94 KDM4E (0.45) KDM4EALDH1A1HPGDBCL2KMT2A
SCHEMBL16066162 0.93 KDM4E (0.38) KDM4EALDH1A1HPGDBCL2KMT2A
SCHEMBL16066916 0.91 HPGD (0.39) KDM4EALDH1A1HPGDBCL2KMT2A
SCHEMBL16066413 0.90 MAPT (0.42) KDM4EALDH1A1HPGDBCL2KMT2A
SCHEMBL16066346 0.89 HPGD (0.41) KDM4EALDH1A1HPGDBCL2KMT2A
SCHEMBL16066705 0.89 HPGD (0.40) KDM4EALDH1A1HPGDBCL2KMT2A
SCHEMBL16066337 0.89 HPGD (0.41) KDM4EALDH1A1HPGDBCL2KMT2A
SCHEMBL16066533 0.88 HPGD (0.39) KDM4EALDH1A1HPGDBCL2KMT2A
SCHEMBL16066518 0.87 BCL2 (0.43) KDM4EALDH1A1HPGDBCL2KMT2A
SCHEMBL16066351 0.87 HPGD (0.41) KDM4EALDH1A1HPGDBCL2KMT2A

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