SCHEMBL20009913

SCHEMBL20009913

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccc5[nH]c6ccc(-c7ccc(-c8cccnc8)nc7)cc6c5c4)n3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 4/20 0.46
TLR7 Q9NYK1 4/20 0.46
TLR9 Q9NR96 2/20 0.46
PIM1 P11309 3/20 0.45
PIM3 Q86V86 2/20 0.45
PIM2 Q9P1W9 2/20 0.45
CDK7 P50613 1/20 0.45
CYP19A1 P11511 2/20 0.45
WNT1 P04628 1/20 0.43
MAPT P10636 1/20 0.43
CLK2 P49760 1/20 0.42
CLK3 P49761 1/20 0.42
DYRK1A Q13627 1/20 0.42
DHODH Q02127 1/20 0.42
CYP2A6 P11509 1/20 0.42
HPGDS O60760 1/20 0.42
CYP17A1 P05093 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
CHEK1 O14757 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
SCHEMBL20009871 0.99 TLR8 (0.47) TLR8TLR7TLR9PIM1PIM3
SCHEMBL20009907 0.96 TLR8 (0.44) TLR8TLR7TLR9PIM1PIM3
SCHEMBL20009965 0.95 TLR8 (0.45) TLR8TLR7TLR9PIM1PIM3
SCHEMBL20009938 0.89 MKNK1 (0.47) MAPTHPGDSCYP11B1CYP11B2GABRA1
SCHEMBL20009872 0.88 MKNK1 (0.45) TLR8TLR7TLR9MAPTDHODH
SCHEMBL20010077 0.88 MKNK1 (0.45) MAPTDHODHHPGDSCYP11B1CYP11B2
SCHEMBL20010279 0.88 MKNK1 (0.45) MAPTDHODHHPGDSCYP11B1CYP11B2
SCHEMBL20010044 0.87 CYP19A1 (0.48) PIM1PIM3PIM2CDK7CYP19A1
SCHEMBL20009986 0.86 CYP19A1 (0.53) CYP19A1MAPTDHODHCYP2A6HPGDS
SCHEMBL20010036 0.86 CYP19A1 (0.53) CYP19A1MAPTDHODHCYP2A6HPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210320261-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2021-10-14 US disclosed
US-11081648-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2021-08-03 US disclosed
US-10468605-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2019-11-05 US disclosed
US-20180090686-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2018-03-29 US disclosed
US-20180090686-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2018-03-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180090686-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME OCIAD1, OCIAD2, AOX1 TLR8 2246/4885TLR7 2845/4885TLR9 2935/4885
US-20210320261-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME OCIAD1, OCIAD2, AOX1 TLR8 2537/4885TLR7 2938/4885TLR9 3020/4885
US-10468605-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same OCIAD1, OCIAD2, AOX1 TLR8 2246/4885TLR7 2845/4885TLR9 2935/4885
US-11081648-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same OCIAD1, OCIAD2, AOX1 TLR8 2246/4885TLR7 2845/4885TLR9 2935/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.