SCHEMBL19233003

SCHEMBL19233003

c1cnc2nc3c4cccnc4c4ncccc4c3nc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.53
L3MBTL1 Q9Y468 5/20 0.47
HSP90AA1 P07900 2/20 0.47
NPC1 O15118 1/20 0.47
LMNA P02545 2/20 0.46
ALDH1A1 P00352 3/20 0.45
CCR1 P32246 4/20 0.43
CCR8 P51685 4/20 0.43
CYP3A4 P08684 2/20 0.42
KDM4E B2RXH2 4/20 0.41
MAPT P10636 3/20 0.41
CCR5 P51681 2/20 0.41
GMNN O75496 1/20 0.41
TP53 P04637 1/20 0.41
MMP2 P08253 1/20 0.41
CYP2D6 P10635 1/20 0.41
MMP9 P14780 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
NFKB1 P19838 1/20 0.41

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
SCHEMBL166826 0.87 L3MBTL1 (0.54) DHFRL3MBTL1HSP90AA1NPC1LMNA
SCHEMBL29390114 0.87 L3MBTL1 (0.54) DHFRL3MBTL1HSP90AA1NPC1LMNA
SCHEMBL30185055 0.87 L3MBTL1 (0.54) DHFRL3MBTL1HSP90AA1NPC1LMNA
SCHEMBL30185058 0.87 L3MBTL1 (0.54) DHFRL3MBTL1HSP90AA1NPC1LMNA
SCHEMBL6693951 0.85 L3MBTL1 (0.52) DHFRL3MBTL1HSP90AA1NPC1LMNA
SCHEMBL29833113 0.85 L3MBTL1 (0.52) DHFRL3MBTL1HSP90AA1NPC1LMNA
Hydrochloric Acid SCHEMBL5931379 0.85 L3MBTL1 (0.52) DHFRL3MBTL1HSP90AA1NPC1LMNA
SCHEMBL13344056 0.85 ALDH1A1 (0.48) HSP90AA1NPC1LMNAALDH1A1CCR1
SCHEMBL16635990 0.83 L3MBTL1 (0.50) DHFRL3MBTL1HSP90AA1NPC1LMNA
SCHEMBL351170 0.83 L3MBTL1 (0.50) DHFRL3MBTL1HSP90AA1NPC1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017146420-A1 LED PACKAGE COMPRISING RED ORGANIC-INORGANIC HYBRID LIGHT-EMITTING MATERIAL AND BACKLIGHT UNIT EMPLOYING SAME 주식회사 효성 2017-08-31 WO disclosed
WO-2017138764-A1 RED ORGANIC-INORGANIC COMPOSITE LIGHT EMITTING MATERIAL AND METHOD FOR PRODUCING SAME 주식회사 효성 2017-08-17 WO disclosed
WO-2017138765-A1 LED LIGHT EMITTING DEVICE COMPRISING RED ORGANIC-INORGANIC COMPOSITE LIGHT EMITTING MATERIAL 주식회사 효성 2017-08-17 WO disclosed