SCHEMBL23124362

SCHEMBL23124362

COc1cc(C(C)=O)ccc1OCCCC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.54
▸ MAOB P27338 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ POLB P06746 1/20 0.48
▸ MEN1 O00255 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ PRSS1 P07477 2/20 0.42
▸ HTT P42858 1/20 0.42
▸ THRA P10827 1/20 0.42
▸ THRB P10828 1/20 0.42

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
SCHEMBL7355038 0.81 KMT2A (0.65) KMT2AMAOBMEN1ALDH1A1PRSS1
SCHEMBL6856717 0.78 KMT2A (0.76) KMT2AMAOBMEN1ALDH1A1PRSS1
SCHEMBL14331174 0.78 KMT2A (0.64) KMT2AMAOBMEN1PRSS1THRA
SCHEMBL2553169 0.78 KMT2A (0.63) KMT2AMAOBPOLBMEN1ALDH1A1
SCHEMBL7273154 0.77 THRA (0.55) KDM4EPOLBHPGDHSD17B10PRSS1
SCHEMBL26490528 0.77 POLB (0.40) KMT2AKDM4EPOLBMEN1HTT
SCHEMBL7954068 0.76 MCL1 (0.52) KMT2AKDM4EPOLBMEN1ALDH1A1
SCHEMBL7953867 0.76 MCL1 (0.52) KMT2AKDM4EPOLBMEN1ALDH1A1
SCHEMBL1545288 0.76 KMT2A (0.64) KMT2AMAOBMEN1PRSS1HTT
SCHEMBL6973871 0.76 KMT2A (0.64) KMT2AMAOBMEN1ALDH1A1PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230137943-A1 PHOTOPROXIMITY PROFILING OF PROTEIN-PROTEIN INTERACTIONS IN CELLS THE UNIVERSITY OF CHICAGO 2023-05-04 — — US disclosed
EP-4031550-A1 PHOTOPROXIMITY PROFILING OF PROTEIN-PROTEIN INTERACTIONS IN CELLS The University of Chicago (US) 2022-07-27 — — EP disclosed
CN-114728970-A Optical proximity analysis of protein-protein interactions in cells 芝加哥大学 2022-07-08 — — CN disclosed
WO-2021055960-A1 PHOTOPROXIMITY PROFILING OF PROTEIN-PROTEIN INTERACTIONS IN CELLS THE UNIVERSITY OF CHICAGO (US) 2021-03-25 — — 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 (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-20230137943-A1 PHOTOPROXIMITY PROFILING OF PROTEIN-PROTEIN INTERACTIONS IN CELLS PPIA, S100A4, S100A6 KMT2A 3560/4885MAOB 3324/4885KDM4E 3501/4885

“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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