SCHEMBL21766554

SCHEMBL21766554

CC(C)c1cc(N(c2ccc(-c3cccc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)c3)cc2F)c2cccc3c2oc2ccccc23)c2ccc3c(C(C)C)cc(N(c4ccc(-c5cccc([Si](c6ccccc6)(c6ccccc6)c6ccccc6)c5)cc4F)c4cccc5c4oc4ccccc45)c4ccc1c2c34

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.30
PARP1 P09874 1/20 0.30
TNKS2 Q9H2K2 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
PARP2 Q9UGN5 1/20 0.30

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
SCHEMBL22489308 0.96 TNKS (0.30) TNKSPARP1TNKS2HDAC6PARP2
SCHEMBL22383632 0.95 MAOB (0.31)
SCHEMBL22488920 0.93 TNKS (0.30) TNKSPARP1TNKS2HDAC6PARP2
SCHEMBL21766551 0.91 MAOB (0.33) TNKSPARP1TNKS2PARP2
SCHEMBL22489309 0.89 TNKS (0.30) TNKSPARP1TNKS2HDAC6PARP2
SCHEMBL22488916 0.89 TNKS (0.31) TNKSPARP1TNKS2HDAC6PARP2
SCHEMBL22488930 0.88 MAOB (0.31)
SCHEMBL22489310 0.88
SCHEMBL22488912 0.88
SCHEMBL21766548 0.88 ALOX5 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3702359-B1 COMPOUND, COATING COMPOSITION COMPRISING SAME, ORGANIC LIGHT-EMITTING ELEMENT USING SAME, AND MANUFACTURING METHOD THEREFOR LG CHEMICAL LTD (KR) 2024-01-24 EP disclosed
US-20200313099-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Element Using Same, and Manufacturing Method Therefor LG CHEM, LTD. (KR) 2020-10-01 US disclosed
EP-3702359-A1 COMPOUND, COATING COMPOSITION COMPRISING SAME, ORGANIC LIGHT-EMITTING ELEMENT USING SAME, AND MANUFACTURING METHOD THEREFOR LG CHEM, LTD. (KR) 2020-09-02 EP disclosed
WO-2020040585-A1 COMPOUND, COATING COMPOSITION COMPRISING SAME, ORGANIC LIGHT-EMITTING ELEMENT USING SAME, AND MANUFACTURING METHOD THEREFOR 주식회사 엘지화학 2020-02-27 WO 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-20200313099-A1 Compound, Coating Composition Comprising Same, Organic Light-Emitting Element Using Same, and Manufacturing Method Therefor SEM1, NOTUM, ORMDL3 TNKS 4216/4885PARP1 3766/4885TNKS2 4505/4885

“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.