Sugi Predict

Sugi Predict / Compounds / SCHEMBL16263283

SCHEMBL16263283

SCHEMBL16263283

CN(C)c1ccc2c(c1)[Si](C)(C)C1=CC(=[N+](C)C)C=CC1=C2c1ccccc1C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 2/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ HIF1A Q16665 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL23945183 0.91 THRB (0.32) THRBMAPK1HIF1AHSD17B10TDP1
SCHEMBL21683656 0.91 THRB (0.36) THRBMAPK1HIF1AHSD17B10TDP1
SCHEMBL21845028 0.91 — —
SCHEMBL16263284 0.89 THRB (0.34) THRBMAPK1HIF1AHSD17B10TDP1
SCHEMBL16263272 0.89 THRB (0.33) THRBMAPK1HIF1AHSD17B10TDP1
SCHEMBL21710473 0.88 THRB (0.32) THRBMAPK1HIF1AHSD17B10TDP1
SCHEMBL23945030 0.87 THRB (0.32) THRBMAPK1HIF1AHSD17B10TDP1
SCHEMBL23945091 0.87 THRB (0.32) THRBMAPK1HIF1AHSD17B10TDP1
SCHEMBL17998183 0.86 THRB (0.32) THRBMAPK1HIF1AHSD17B10TDP1
SCHEMBL26221858 0.86 MEN1 (0.31) MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210324198-A1 SILICON-SUBSTITUTED RHODAMINE DYES AND DYE CONJUGATES Life Technologies Corporation 2021-10-21 — — US disclosed
US-9701841-B2 Cell permeable, fluorescent dye ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2017-07-11 — — US disclosed
EP-2748173-B1 CELL PERMEABLE, FLUORESCENT DYE ECOLE POLYTECH (CH) 2016-11-23 — — EP disclosed
US-20160230011-A1 CELL PERMEABLE, FLUORESCENT DYE ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2016-08-11 — — US disclosed
US-9346957-B2 Cell permeable, fluorescent dye ÉCOLE POLYTECHNIQUE FÉDÉRALE DE LAUSANNE (EPFL) (CH) 2016-05-24 — — US disclosed
US-20140349282-A1 Cell Permeable, Fluorescent Dye ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2014-11-27 — — 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-20210324198-A1 SILICON-SUBSTITUTED RHODAMINE DYES AND DYE CONJUGATES SRI, SI, IK THRB 2646/4885MAPK1 3818/4885HIF1A 2103/4885
US-20160230011-A1 CELL PERMEABLE, FLUORESCENT DYE EPCAM, IK, TSPO THRB 2049/4885MAPK1 4376/4885HIF1A 2387/4885

“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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