Sugi Predict

Sugi Predict / Compounds / SCHEMBL20420116

SCHEMBL20420116

SCHEMBL20420116

CC(=O)Oc1cc2c(cc1Cl)C1(OC(=O)c3cc(C(=O)O)ccc31)c1cc(Cl)c(OC(C)=O)cc1O2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ MAPT P10636 3/20 0.52
▸ HTT P42858 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ USP2 O75604 2/20 0.52
▸ LMNA P02545 2/20 0.52
▸ GSTP1 P09211 1/20 0.52
▸ TTR P02766 2/20 0.43
▸ FTO Q9C0B1 9/20 0.43
▸ TSHR P16473 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ GAA P10253 2/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ RECQL P46063 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ SMAD3 P84022 1/20 0.40

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
SCHEMBL29382186 1.00 ALDH1A1 (0.52) ALDH1A1MEN1MAPTHTTKMT2A
SCHEMBL20419954 0.92 ALDH1A1 (0.49) ALDH1A1MEN1MAPTHTTKMT2A
SCHEMBL13212097 0.88 ALDH1A1 (0.52) ALDH1A1MEN1MAPTHTTKMT2A
SCHEMBL30378493 0.88 ALDH1A1 (0.52) ALDH1A1MEN1MAPTHTTKMT2A
SCHEMBL13620743 0.86 FTO (0.57) ALDH1A1MEN1MAPTHTTKMT2A
SCHEMBL1024927 0.86 MAPT (0.66) ALDH1A1MEN1MAPTHTTKMT2A
SCHEMBL29349570 0.86 MAPT (0.66) ALDH1A1MEN1MAPTHTTKMT2A
SCHEMBL10123085 0.83 ALDH1A1 (0.48) ALDH1A1MEN1MAPTHTTKMT2A
SCHEMBL6663204 0.83 MEN1 (0.75) ALDH1A1MEN1MAPTHTTKMT2A
SCHEMBL29663660 0.83 MEN1 (0.75) ALDH1A1MEN1MAPTHTTKMT2A

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-10884004-B2 Taggable fluorescent probe for calcium ion detection THE UNIVERSITY OF TOKYO (JP) 2021-01-05 — — US disclosed
US-10884004-B2 Taggable fluorescent probe for calcium ion detection THE UNIVERSITY OF TOKYO (JP) 2021-01-05 — — US disclosed
US-20200199174-A1 NOVEL FLUORESCENT LABELING METHOD THE UNIVERSITY OF TOKYO (JP) 2020-06-25 — — US disclosed
US-20190094248-A1 TAGGABLE FLUORESCENT PROBE FOR CALCIUM ION DETECTION THE UNIVERSITY OF TOKYO (JP) 2019-03-28 — — US disclosed
US-20190094248-A1 TAGGABLE FLUORESCENT PROBE FOR CALCIUM ION DETECTION THE UNIVERSITY OF TOKYO (JP) 2019-03-28 — — US disclosed
WO-2018135598-A1 NOVEL FLUORESCENT LABELING METHOD 国立大学法人 東京大学 2018-07-26 — — WO 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 (3 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-20190094248-A1 TAGGABLE FLUORESCENT PROBE FOR CALCIUM ION DETECTION CACNA1G, CACNA1F, CACNA1I ALDH1A1 3172/4885MEN1 3097/4885MAPT 1743/4885
US-20200199174-A1 NOVEL FLUORESCENT LABELING METHOD RPS27A, DNPEP, DNM1L ALDH1A1 4779/4885MEN1 3467/4885MAPT 1510/4885
US-10884004-B2 Taggable fluorescent probe for calcium ion detection CACNA1G, CACNA1F, CACNA1I ALDH1A1 3172/4885MEN1 3097/4885MAPT 1743/4885

“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.