SCHEMBL19007066

SCHEMBL19007066

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc(-c5ccc6c(c5)-c5ccccc5C65c6ccccc6N(c6ccccc6)c6ccccc65)cc4)n3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
MAPT P10636 5/20 0.36
ALDH1A1 P00352 4/20 0.36
HPGD P15428 2/20 0.36
PDE6D O43924 1/20 0.36
PDK2 Q15119 3/20 0.35
ADAMTS5 Q9UNA0 1/20 0.34
LMNA P02545 5/20 0.33
KDM4E B2RXH2 3/20 0.33
GLA P06280 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
OPRK1 P41145 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
THPO P40225 1/20 0.32
L3MBTL1 Q9Y468 2/20 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
SCHEMBL19007126 0.98 PDE6D (0.37) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24293090 0.97 MEN1 (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19007078 0.97 MEN1 (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19007506 0.96 PDE6D (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19007045 0.96 PDE6D (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19007121 0.96 PDE6D (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19007119 0.96 PDE6D (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21867807 0.96 MEN1 (0.37) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21867511 0.95 PDE6D (0.37) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24293411 0.95 PDE6D (0.37) MEN1KMT2AMAPTALDH1A1HPGD

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-2017105041-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2017-06-22 WO disclosed