SCHEMBL21813630

SCHEMBL21813630

CNC(=O)c1csc2c(C(F)(F)F)cc(N3CCC(NC(=O)OC)CC3)nc12

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
UGT8 Q16880 19/20 0.81
KDM4E B2RXH2 1/20 0.51

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
SCHEMBL30845016 0.92 UGT8 (0.78) UGT8KDM4E
SCHEMBL21813987 0.91 UGT8 (0.77) UGT8
SCHEMBL21862162 0.91 UGT8 (0.77) UGT8
SCHEMBL21813601 0.91 UGT8 (0.75) UGT8KDM4E
SCHEMBL21813991 0.90 UGT8 (0.80) UGT8
SCHEMBL21814109 0.89 UGT8 (0.76) UGT8
SCHEMBL21862422 0.89 UGT8 (0.81) UGT8
SCHEMBL30845439 0.89 UGT8 (0.81) UGT8
SCHEMBL21813414 0.89 UGT8 (0.80) UGT8
SCHEMBL21862124 0.88 UGT8 (0.80) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 74/4885KDM4E 647/4885

“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.