SCHEMBL19007103

SCHEMBL19007103

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-c4cccc(-c5ccc6c(c5)-c5ccccc5C65c6ccccc6N(c6ccccc6)c6ccccc65)c4)c3)n2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.40
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
LMNA P02545 3/20 0.40
KDM4E B2RXH2 2/20 0.40
GLA P06280 1/20 0.38
NTSR1 P30989 1/20 0.36
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
AGTR1 P30556 2/20 0.33
CYP3A4 P08684 1/20 0.33
GAA P10253 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PDE6D O43924 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPK10 P53779 1/20 0.33

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
SCHEMBL19007131 1.00 MAPT (0.40) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL19007117 0.99 MEN1 (0.39) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL24646714 0.98 MEN1 (0.41) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL19007089 0.96 MEN1 (0.41) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL19007118 0.96 MEN1 (0.41) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL21867592 0.95 MAPT (0.36) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL19007064 0.94 MEN1 (0.38) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL19007272 0.94 MEN1 (0.38) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL21868644 0.94 MAPT (0.38) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL19007046 0.94 MEN1 (0.43) MAPTMEN1KMT2AALDH1A1HPGD

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