SCHEMBL16066356

SCHEMBL16066356

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-n5c6ccccc6c6ccc7c(c8ccccc8n8c9ccccc9nc78)c65)cc4)c3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.40
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 4/20 0.40
KMT2A Q03164 6/20 0.38
MAPT P10636 4/20 0.38
MEN1 O00255 4/20 0.38
CAMKK1 Q8N5S9 2/20 0.38
CAMKK2 Q96RR4 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CASP1 P29466 1/20 0.38
CYP2C19 P33261 1/20 0.38
CASP7 P55210 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
BCL2 P10415 1/20 0.36
POLB P06746 3/20 0.36
HSD17B10 Q99714 2/20 0.36
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 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
SCHEMBL16066392 0.95 HPGD (0.44) HPGDALDH1A1KDM4EKMT2AMAPT
SCHEMBL16066391 0.94 KDM4E (0.45) HPGDALDH1A1KDM4EKMT2AMAPT
SCHEMBL16066351 0.93 HPGD (0.41) HPGDALDH1A1KDM4EKMT2AMAPT
SCHEMBL16066165 0.93 ALDH1A1 (0.39) HPGDALDH1A1KDM4EKMT2AMAPT
SCHEMBL16066346 0.93 HPGD (0.41) HPGDALDH1A1KDM4EKMT2AMAPT
SCHEMBL16066945 0.91 ALDH1A1 (0.40) HPGDALDH1A1KDM4EKMT2AMAPT
SCHEMBL16066355 0.91 KDM4E (0.43) HPGDALDH1A1KDM4EKMT2AMAPT
SCHEMBL16066378 0.91 HPGD (0.43) HPGDALDH1A1KDM4EKMT2AMAPT
SCHEMBL16066885 0.90 HPGD (0.39) HPGDALDH1A1KDM4EKMT2AMAPT
SCHEMBL16066790 0.89 HPGD (0.41) HPGDALDH1A1KDM4EKMT2AMAPT

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