SCHEMBL22064786

SCHEMBL22064786

CC1(C)OB(c2ccc(-c3ccc(-c4ccc(C#N)cc4)cc3)c3ccccc23)OC1(C)C

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.42
LIPG Q9Y5X9 7/20 0.42
PDK2 Q15119 1/20 0.35
TNKS O95271 1/20 0.35
KIF11 P52732 2/20 0.34
MMP3 P08254 1/20 0.33
TDO2 P48775 1/20 0.33
SLC22A12 Q96S37 1/20 0.32
PGR P06401 1/20 0.32
CYP11B2 P19099 2/20 0.32
ALDH1A1 P00352 1/20 0.31
ATM Q13315 1/20 0.31

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
SCHEMBL30233361 0.99 LPL (0.40) LPLLIPGPDK2TNKSKIF11
SCHEMBL21878519 0.99 LPL (0.40) LPLLIPGPDK2TNKSKIF11
SCHEMBL20699261 0.88 LIPG (0.58) LPLLIPGPDK2TNKSKIF11
SCHEMBL23624415 0.86 LIPG (0.55) LPLLIPGTNKS
SCHEMBL20944840 0.86 LIPG (0.57) LPLLIPG
SCHEMBL24130907 0.84 LPL (0.37) LPLLIPGPDK2TNKSSLC22A12
SCHEMBL16557794 0.83 TNKS (0.37) LPLLIPGTNKSPGRALDH1A1
SCHEMBL15411720 0.83 LPL (0.42) LPLLIPGPDK2KIF11MMP3
SCHEMBL17035144 0.82 LIPG (0.51) LPLLIPG
SCHEMBL29587879 0.82 LIPG (0.51) LPLLIPG

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
US-20220220083-A1 COMPOUND HAVING BENZOTRIAZOLE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENCE ELEMENT HODOGAYA CHEMICAL CO., LTD. (JP) 2022-07-14 US disclosed
WO-2020166630-A1 COMPOUND HAVING BENZAZOLE RING STRUCTURE, AND ORGANIC ELECTROLUMINESCENT DEVICE 保土谷化学工業株式会社 2020-08-20 WO disclosed
US-20200181096-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2020-06-11 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 (2 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-20200181096-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY1, CYP1A1, AHR LPL 3204/4885LIPG 4601/4885PDK2 2192/4885
US-20220220083-A1 COMPOUND HAVING BENZOTRIAZOLE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENCE ELEMENT POU2F2, EBPL, POU2F1 LPL 2171/4885LIPG 1510/4885PDK2 3114/4885

“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.