SCHEMBL22356952

SCHEMBL22356952

C=Nc1cccc2c1ncc1cccnc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
LMNA P02545 4/20 0.42
PDE10A Q9Y233 1/20 0.39
MAPT P10636 5/20 0.39
L3MBTL1 Q9Y468 5/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
KDM4E B2RXH2 2/20 0.39
OPRK1 P41145 2/20 0.39
ESR1 P03372 1/20 0.39
POLB P06746 1/20 0.39
AGTR1 P30556 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRD1 P41143 1/20 0.39
CCR1 P32246 4/20 0.38
CCR8 P51685 4/20 0.38
TDP1 Q9NUW8 3/20 0.38
CYP3A4 P08684 3/20 0.38
HIF1A Q16665 2/20 0.38
MMP2 P08253 2/20 0.38

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
SCHEMBL19007833 0.75 CCR1 (0.51) ALDH1A1LMNAMAPTL3MBTL1MEN1
SCHEMBL22333782 0.75 ALDH1A1 (0.50) ALDH1A1LMNAMAPTMEN1KMT2A
SCHEMBL4164142 0.72 LMNA (0.66) ALDH1A1LMNAMAPTL3MBTL1KDM4E
SCHEMBL13192813 0.70 LMNA (0.52) ALDH1A1LMNAMAPTL3MBTL1KDM4E
SCHEMBL25710540 0.68 ALDH1A1 (0.54) ALDH1A1L3MBTL1MEN1KMT2APOLB
Pyrene SCHEMBL433757 0.68 LMNA (0.60) ALDH1A1LMNAMAPTL3MBTL1MEN1
SCHEMBL6919575 0.67 ALDH1A1 (0.49) ALDH1A1LMNAMAPTL3MBTL1KDM4E
SCHEMBL18434584 0.67 PSMD14 (0.57) ALDH1A1KDM4ECCR1CCR8CCR5
1-Naphthoquinoline SCHEMBL29533982 0.67 LMNA (0.69) ALDH1A1LMNAMAPTL3MBTL1KDM4E
1-Naphthoquinoline SCHEMBL15106 0.67 LMNA (0.69) ALDH1A1LMNAMAPTL3MBTL1KDM4E

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
EP-3301097-B1 [1]BENZOTHIENO[3',2':4,5]IMIDAZO[1,2-A]PYRIDINE DERIVATIVES AND RELATED COMPOUNDS FOR USE IN ORGANIC LIGHT-EMITTING DEVICES (OLEDS) SAMSUNG DISPLAY CO LTD (KR) 2020-08-19 EP disclosed