Sugi Predict

Sugi Predict / Compounds / SCHEMBL6749448

SCHEMBL6749448

SCHEMBL6749448

CO[Si](C)(C)c1ccc(N(c2ccccc2)c2cccc(-c3cccc(N(c4ccccc4)c4ccccc4)c3)c2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ TDP1 Q9NUW8 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ FAAH O00519 4/20 0.34
▸ MGLL Q99685 3/20 0.34
▸ SLC16A3 O15427 1/20 0.33
▸ SLC16A1 P53985 1/20 0.33
▸ NOTUM Q6P988 2/20 0.32
▸ TSHR P16473 2/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ ATM Q13315 2/20 0.31
▸ HSD17B1 P14061 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
SCHEMBL6748675 0.92 ALDH1A1 (0.38) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL6748673 0.91 ADRA2A (0.33) ALDH1A1MAPTKDM4ENOTUMMEN1
SCHEMBL6749673 0.88 ALDH1A1 (0.43) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL6749382 0.88 ALDH1A1 (0.43) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL6858697 0.88 ALDH1A1 (0.35) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL6748685 0.87 ALDH1A1 (0.39) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL6748984 0.86 ALDH1A1 (0.36) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL6751440 0.85 KDM4E (0.33) ALDH1A1MAPTL3MBTL1TDP1KDM4E
SCHEMBL6744502 0.83 ACHE (0.35) MAPTTDP1CYP1A2CYP3A4CYP2C9
SCHEMBL6751376 0.83 ADRA2A (0.35) ALDH1A1TSHRAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6696588-B2 OXIDATION POTENTIAL OF .3-1.5 V ON THE BASIS OF A STANDARD HYDROGEN ELECTRODE, ALKOXY AND AROMATIC AMINE DERIVATIVES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-02-24 — — US disclosed
EP-0861845-B1 Silicon-containing compound and organic electroluminescence device using the same SUMITOMO CHEMICAL CO (JP) 2003-05-28 — — EP disclosed
US-20020115877-A1 Silicon-containing compound and organic electroluminescence device using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2002-08-22 — — US disclosed
US-6369258-B1 SILICON COMPOUND WITH OXIDATION POTENTIAL ON HYDROGEN ELECTRODE POTENTIAL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-04-09 — — US disclosed
EP-0861845-A2 Silicon-containing compound and organic electroluminescence device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-09-02 — — EP 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-20020115877-A1 Silicon-containing compound and organic electroluminescence device using the same EPCAM, PIEZO1, OR10J3 ALDH1A1 460/4885MAPT 1203/4885L3MBTL1 2398/4885

“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.