SCHEMBL19232997

SCHEMBL19232997

CCc1ccc2nc3c4cccnc4c4ncccc4c3nc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 2/20 0.42
▸ CCR8 P51685 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ L3MBTL1 Q9Y468 3/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ HSP90AA1 P07900 1/20 0.42
▸ LMNA P02545 3/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ TRPC5 Q9UL62 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ KIF11 P52732 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ DHFR P00374 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ GRM4 Q14833 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL13286604 0.79 DHFR (0.53) CCR1CCR8CYP3A4L3MBTL1NPC1
SCHEMBL30022928 0.79 DHFR (0.53) CCR1CCR8CYP3A4L3MBTL1NPC1
SCHEMBL12577905 0.79 NQO2 (0.58) CCR1CCR8CYP3A4L3MBTL1NPC1
SCHEMBL12553474 0.78 NPC1 (0.50) CCR1CCR8CYP3A4L3MBTL1NPC1
SCHEMBL4371752 0.77 NQO2 (0.54) L3MBTL1NPC1LMNACYP1A2CYP2A6
SCHEMBL166826 0.77 L3MBTL1 (0.54) CCR1CCR8CYP3A4L3MBTL1NPC1
SCHEMBL30185058 0.77 L3MBTL1 (0.54) CCR1CCR8CYP3A4L3MBTL1NPC1
SCHEMBL29390114 0.77 L3MBTL1 (0.54) CCR1CCR8CYP3A4L3MBTL1NPC1
SCHEMBL30185055 0.77 L3MBTL1 (0.54) CCR1CCR8CYP3A4L3MBTL1NPC1
SCHEMBL1007451 0.76 KCNH2 (0.40) CCR1CCR8NPC1HSP90AA1MAPT

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
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