SCHEMBL21363030

SCHEMBL21363030

CO[C@@H]1[C@@H](OC(N)=O)[C@@H](O)[C@H](Oc2ccc3c(O)c(NCl)c(=O)oc3c2C)OC1(C)C

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 5/20 0.68
HSP90AA1 P07900 4/20 0.68
MAP1LC3B Q9GZQ8 2/20 0.68
MAP1LC3A Q9H492 2/20 0.68
POLQ O75417 1/20 0.68
ALB P02768 1/20 0.68
KDR P35968 1/20 0.68
ABCG2 Q9UNQ0 1/20 0.68
LMNA P02545 1/20 0.65
KDM4E B2RXH2 1/20 0.60

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
SCHEMBL22023535 1.00 HSP90AB1 (0.68) HSP90AB1HSP90AA1MAP1LC3BMAP1LC3APOLQ
SCHEMBL22023815 1.00 HSP90AB1 (0.68) HSP90AB1HSP90AA1MAP1LC3BMAP1LC3APOLQ
SCHEMBL24589015 0.93 HSP90AB1 (0.68) HSP90AB1HSP90AA1MAP1LC3BMAP1LC3APOLQ
SCHEMBL17049899 0.91 HSP90AB1 (0.73) HSP90AB1HSP90AA1MAP1LC3BMAP1LC3APOLQ
SCHEMBL10306489 0.91 HSP90AB1 (0.73) HSP90AB1HSP90AA1MAP1LC3BMAP1LC3APOLQ
SCHEMBL6935655 0.91 HSP90AB1 (0.73) HSP90AB1HSP90AA1MAP1LC3BMAP1LC3APOLQ
SCHEMBL13644903 0.91 HSP90AB1 (0.73) HSP90AB1HSP90AA1MAP1LC3BMAP1LC3APOLQ
SCHEMBL21363200 0.91 HSP90AB1 (0.73) HSP90AB1HSP90AA1MAP1LC3BMAP1LC3APOLQ
SCHEMBL21363092 0.89 HSP90AB1 (0.56) HSP90AB1HSP90AA1MAP1LC3BMAP1LC3APOLQ
SCHEMBL21363211 0.88 HSP90AB1 (0.67) HSP90AB1HSP90AA1MAP1LC3BMAP1LC3APOLQ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11713335-B2 Aminocoumarin compounds and methods of their use PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2023-08-01 US disclosed
US-20210009621-A1 AMINOCOUMARIN COMPOUNDS AND METHODS OF THEIR USE PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2021-01-14 US disclosed
WO-2019178119-A1 AMINOCOUMARIN COMPOUNDS AND METHODS OF THEIR USE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2019-09-19 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 (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-20210009621-A1 AMINOCOUMARIN COMPOUNDS AND METHODS OF THEIR USE AAAS, PROC, AADAC HSP90AB1 1341/4885HSP90AA1 1344/4885MAP1LC3B 3338/4885
US-11713335-B2 Aminocoumarin compounds and methods of their use AAAS, PROC, AADAC HSP90AB1 1341/4885HSP90AA1 1344/4885MAP1LC3B 3338/4885

“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.