SCHEMBL16284624

SCHEMBL16284624

c1cncc(-c2ccc3[nH]c4ccc(-c5cccnc5)cc4c3c2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 4/20 0.59
TLR7 Q9NYK1 4/20 0.59
TLR9 Q9NR96 2/20 0.59
ALDH1A1 P00352 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2A6 P11509 1/20 0.56
DYRK1A Q13627 5/20 0.55
CLK2 P49760 4/20 0.55
CLK3 P49761 4/20 0.55
FGFR1 P11362 2/20 0.54
CHEK1 O14757 2/20 0.54
AURKA O14965 1/20 0.54
DAPK3 O43293 1/20 0.54
JAK2 O60674 1/20 0.54
PRKD3 O94806 1/20 0.54
MAP4K4 O95819 1/20 0.54
PAK4 O96013 1/20 0.54
ABL1 P00519 1/20 0.54
LCK P06239 1/20 0.54

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
SCHEMBL29216254 0.93 TLR8 (0.57) TLR8TLR7TLR9ALDH1A1CYP1A2
SCHEMBL29966067 0.83 CYP11B1 (0.56) TLR8TLR7TLR9ALDH1A1CYP1A2
SCHEMBL16610292 0.82 MAPT (0.63) TLR8TLR7TLR9ALDH1A1CYP1A2
SCHEMBL6123307 0.81 MAOA (0.55) TLR8TLR7TLR9ALDH1A1CYP1A2
SCHEMBL18135487 0.80 CHUK (0.64) ALDH1A1AURKAJAK2PIM1MKNK1
SCHEMBL20009913 0.79 TLR8 (0.46) TLR8TLR7TLR9CYP2A6DYRK1A
SCHEMBL2552499 0.79 KDM4E (0.53) TLR8TLR7TLR9CYP3A4DYRK1A
SCHEMBL12868091 0.79 SIRT2 (0.50) TLR8TLR7TLR9DYRK1ACLK2
SCHEMBL21834364 0.79 PDE10A (0.62) TLR8TLR7TLR9DYRK1ACLK2
SCHEMBL10213963 0.78 JAK2 (0.69) DYRK1ACLK2CLK3FGFR1CHEK1

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-20210143342-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AROMATIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-05-13 US disclosed
US-9705093-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-11 US disclosed
US-9705093-B2 Heterocyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-11 US disclosed
US-20140361268-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-12-11 US disclosed
US-20140361268-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-12-11 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 (1 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-20210143342-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND AROMATIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE CTCF, LEF1, BRD4 TLR8 3206/4885TLR7 2308/4885TLR9 3135/4885

“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.