SCHEMBL21813626

SCHEMBL21813626

CNC(=O)c1c(C)sc2c(C(F)(F)F)cc(OC3CC4(C3)CN(C(=O)OCCOC(F)(F)F)C4)nc12

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 2/20 0.37
▸ UGT8 Q16880 12/20 0.36
▸ P2RX3 P56373 1/20 0.32
▸ P2RX2 Q9UBL9 1/20 0.32
▸ ABHD6 Q9BV23 5/20 0.31
▸ MGLL Q99685 2/20 0.31

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
SCHEMBL30844983 0.87 P2RX3 (0.42) LOXL2UGT8P2RX3P2RX2ABHD6
SCHEMBL21814142 0.87 LOXL2 (0.39) LOXL2UGT8P2RX3P2RX2ABHD6
SCHEMBL21813978 0.86 UGT8 (0.51) LOXL2UGT8
SCHEMBL21814007 0.75 UGT8 (0.56) UGT8
SCHEMBL21813930 0.75 UGT8 (0.47) LOXL2UGT8
SCHEMBL21813856 0.74 UGT8 (0.59) UGT8
SCHEMBL21813796 0.73 UGT8 (0.47) UGT8
SCHEMBL21814005 0.73 UGT8 (0.52) UGT8
SCHEMBL21813710 0.73 UGT8 (0.51) UGT8
SCHEMBL21814076 0.73 UGT8 (0.52) UGT8

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 LOXL2 451/4885UGT8 74/4885P2RX3 3997/4885

“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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