SCHEMBL19654672

SCHEMBL19654672

c1ccc([Si]2(c3ccccc3)c3ccccc3N(c3ccc(-c4ncccn4)cc3)c3ccccc32)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.33
▸ CLK4 Q9HAZ1 1/20 0.33
▸ ADRB2 P07550 1/20 0.33
▸ AVPR2 P30518 1/20 0.33
▸ OXTR P30559 1/20 0.33
▸ AVPR1A P37288 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PTK2B Q14289 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ HPGDS O60760 1/20 0.31
▸ FAAH O00519 1/20 0.30
▸ MGLL Q99685 1/20 0.30
▸ TNKS2 Q9H2K2 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ NFKB1 P19838 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ NFKB2 Q00653 1/20 0.30
▸ RELA Q04206 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL31301119 0.87 L3MBTL1 (0.37) MAPTKMT2ANPSR1FAAHMGLL
SCHEMBL20347852 0.87 L3MBTL1 (0.37) MAPTKMT2ANPSR1FAAHMGLL
SCHEMBL20022918 0.86 FAAH (0.40) KMT2ANPSR1FAAHMGLL
SCHEMBL19654673 0.85 CLK4 (0.33) HDAC4CLK4ADRB2AVPR2OXTR
SCHEMBL19829080 0.85 PDE6D (0.38) AVPR1AMAPTKMT2AFAAHMGLL
SCHEMBL20347849 0.84 L3MBTL1 (0.35) MAPTKMT2AFAAHMGLL
SCHEMBL20383373 0.83 MGLL (0.38) NPSR1FAAHMGLL
SCHEMBL20383361 0.81 GAA (0.35) KMT2ANPSR1MGLL
SCHEMBL20689873 0.80 ALDH1A1 (0.33) —
SCHEMBL19499747 0.80 NR1H4 (0.50) MAPTKMT2ANPSR1NPC1NFKB1

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-10686139-B2 Nitrogen-containing compound and organic electroluminescence device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-16 — — US disclosed
US-20170346017-A1 NITROGEN-CONTAINING COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-30 — — US disclosed
US-20170346017-A1 NITROGEN-CONTAINING COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-30 — — 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-20170346017-A1 NITROGEN-CONTAINING COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME NOM1, NOS1, NPM1 HDAC4 4548/4885CLK4 3773/4885ADRB2 3707/4885
US-10686139-B2 Nitrogen-containing compound and organic electroluminescence device including the same NOM1, NOS1, NPM1 HDAC4 4548/4885CLK4 3773/4885ADRB2 3707/4885

“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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