SCHEMBL20923013

SCHEMBL20923013

CC1(C)OB(c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2F)OC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 6/20 0.46
LPL P06858 5/20 0.46
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 7/20 0.36
KMT2A Q03164 7/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
PKM P14618 1/20 0.33
NFKB1 P19838 1/20 0.33
MAPK1 P28482 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
NTSR1 P30989 1/20 0.33
LMNA P02545 2/20 0.33
ATM Q13315 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL20654912 0.89 LIPG (0.46) LIPGLPLL3MBTL1MEN1KMT2A
SCHEMBL23676982 0.88 LIPG (0.49) LIPGLPLL3MBTL1MEN1KMT2A
SCHEMBL30514721 0.87 LIPG (0.57) LIPGLPLALDH1A1MAPK1DGAT1
SCHEMBL3794764 0.87 LIPG (0.57) LIPGLPLALDH1A1MAPK1DGAT1
SCHEMBL24780967 0.84 LIPG (0.47) LIPGLPLL3MBTL1MEN1KMT2A
SCHEMBL23676989 0.84 LIPG (0.46) LIPGLPLL3MBTL1
SCHEMBL31453994 0.83 LIPG (0.50) LIPGLPLL3MBTL1MEN1KMT2A
SCHEMBL31453989 0.83 LIPG (0.50) LIPGLPLL3MBTL1MEN1KMT2A
SCHEMBL24043660 0.83 LPL (0.51) LIPGLPLL3MBTL1MEN1KMT2A
SCHEMBL21042445 0.82 LIPG (0.50) LIPGLPL

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3473620-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-02-26 EP disclosed
EP-3473620-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-04-24 EP disclosed