SCHEMBL21814080

SCHEMBL21814080

COC(=O)c1csc2c(OC)cc(N3CCC(OC(=O)NCC4CC4)CC3)nc12

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ UGT8 Q16880 13/20 0.64
▸ ACACB O00763 4/20 0.42
▸ ACACA Q13085 4/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ NAPEPLD Q6IQ20 2/20 0.38

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
SCHEMBL30845146 1.00 UGT8 (0.64) UGT8ACACBACACAKDM4ENAPEPLD
SCHEMBL21813753 0.87 UGT8 (0.83) UGT8KDM4E
SCHEMBL21813377 0.86 UGT8 (0.49) UGT8KDM4E
SCHEMBL30844944 0.86 UGT8 (0.49) UGT8KDM4E
SCHEMBL21862463 0.80 UGT8 (0.78) UGT8ACACBACACA
SCHEMBL21813589 0.79 UGT8 (0.83) UGT8
SCHEMBL21862127 0.78 UGT8 (1.00) UGT8
Hydrochloric Acid SCHEMBL21814166 0.77 UGT8 (0.98) UGT8
SCHEMBL21813832 0.77 UGT8 (0.76) UGT8
Hydrochloric Acid SCHEMBL21814153 0.77 UGT8 (0.88) UGT8ACACBACACA

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
EP-3861000-A1 THIENO[3,2-B]PYRIDINE DERIVATIVES AS UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE Genzyme Corporation (US) 2021-08-11 — — EP disclosed
WO-2020072504-A1 THIENO[3,2-B]PYRIDINE DERIVATIVES AS UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE GENZYME CORPORATION (US) 2020-04-09 — — WO disclosed
US-20200102324-A1 UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE GENZYME CORPORATION 2020-04-02 — — 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 (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-20200102324-A1 UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE MAN2B1, GAA, GBA1 UGT8 74/4885ACACB 284/4885ACACA 578/4885

“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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