SCHEMBL20689873

SCHEMBL20689873

c1ccc(N2c3ccccc3[Si]3(c4ccccc42)c2ccccc2C2(c4ccccc4N(c4ccc(-c5ncccn5)cc4)c4ccccc42)c2ccccc23)cc1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ THPO P40225 1/20 0.33
▸ EGLN1 Q9GZT9 3/20 0.33
▸ MAPK1 P28482 1/20 0.32
▸ ADAMTS5 Q9UNA0 1/20 0.31
▸ HTT P42858 1/20 0.30
▸ HSD17B10 Q99714 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
SCHEMBL20689871 0.88 EGLN1 (0.40) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL20689907 0.87 ALDH1A1 (0.39) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL20689868 0.85 MEN1 (0.39) ALDH1A1CYP1A2CYP2C9CYP2C19MAPK1
SCHEMBL20689872 0.83 ALDH1A1 (0.36) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL19654661 0.83 ALDH1A1 (0.35) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL19654673 0.83 CLK4 (0.33) ALDH1A1HTTHSD17B10
SCHEMBL20689874 0.82 ALDH1A1 (0.35) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL19654658 0.80 EGLN1 (0.36) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL19654672 0.80 HDAC4 (0.33) —
SCHEMBL20689869 0.80 HTT (0.41) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11018306-B2 Compound for thermally activated delayed fluorescence and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2021-05-25 — — US disclosed
US-20190036034-A1 COMPOUND FOR THERMALLY ACTIVATED DELAYED FLUORESCENCE AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-01-31 — — 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-11018306-B2 Compound for thermally activated delayed fluorescence and organic electroluminescence device including the same TRPA1, SLCO2A1, TMEM109 ALDH1A1 81/4885CYP1A2 1396/4885CYP3A4 775/4885
US-20190036034-A1 COMPOUND FOR THERMALLY ACTIVATED DELAYED FLUORESCENCE AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME TRPA1, SLCO2A1, TMEM109 ALDH1A1 81/4885CYP1A2 1396/4885CYP3A4 775/4885

“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.

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