SCHEMBL20022913

SCHEMBL20022913

c1ccc([Si]2(c3ccccc3)c3ccccc3N(c3ccc(-c4cccc(-c5ccc(N6c7ccccc7[Si](c7ccccc7)(c7ccccc7)c7ccccc76)cc5)c4)cc3)c3ccccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE6D O43924 1/20 0.39
▸ MGLL Q99685 3/20 0.39
▸ FAAH O00519 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ MEN1 O00255 1/20 0.32
▸ ESR1 P03372 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ ACMSD Q8TDX5 1/20 0.32
▸ KMO O15229 1/20 0.32
▸ HDAC4 P56524 1/20 0.32
▸ HDAC2 Q92769 1/20 0.32
▸ HDAC8 Q9BY41 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ HTR1A P08908 1/20 0.31
▸ HTR7 P34969 1/20 0.31
▸ ALOX5 P09917 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
SCHEMBL20022912 0.94 ALDH1A1 (0.44) PDE6DMGLLFAAHALDH1A1HSP90AA1
SCHEMBL20022918 0.92 FAAH (0.40) PDE6DMGLLFAAHALDH1A1MEN1
SCHEMBL16017498 0.89 ALDH1A1 (0.47) MGLLFAAHALDH1A1HSP90AA1PKM
SCHEMBL20022917 0.89 ALDH1A1 (0.44) MGLLFAAHALDH1A1HSP90AA1PKM
SCHEMBL20383373 0.89 MGLL (0.38) PDE6DMGLLFAAHALDH1A1
SCHEMBL20022901 0.88 FAAH (0.39) PDE6DMGLLFAAHALDH1A1HSP90AA1
SCHEMBL20152419 0.87 PDE6D (0.32) PDE6DMGLLFAAH
SCHEMBL20022916 0.87 FAAH (0.34) MGLLFAAHALDH1A1HSP90AA1PKM
SCHEMBL20022914 0.87 ALDH1A1 (0.45) MGLLFAAHALDH1A1HSP90AA1PKM
SCHEMBL19829080 0.85 PDE6D (0.38) PDE6DMGLLFAAHALDH1A1HTT

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-20180097181-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-04-05 — — US disclosed
US-20180097181-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2018-04-05 — — 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-20180097181-A1 POLYCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME PKD1, PIEZO1, ETV6 PDE6D 4001/4885MGLL 3711/4885FAAH 2834/4885

“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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