SCHEMBL21813867

SCHEMBL21813867

COC(=O)c1csc2c(C(F)(F)F)c(C)c(Cl)nc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.41
▸ SOS1 Q07889 1/20 0.34
▸ EIF4EBP1 Q13541 5/20 0.34
▸ CFTR P13569 2/20 0.33
▸ MAPT P10636 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ NFKB2 Q00653 1/20 0.33
▸ RELA Q04206 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ NOTUM Q6P988 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ PABPC1 P11940 1/20 0.32
▸ CRHBP P24387 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ CRHR2 Q13324 1/20 0.32

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
SCHEMBL21814039 0.89 KDM4E (0.41) KDM4ESOS1EIF4EBP1CFTRMAPT
SCHEMBL30845390 0.85 UGT8 (0.42) —
SCHEMBL21813802 0.85 UGT8 (0.42) —
SCHEMBL21813941 0.82 KDM4E (0.41) KDM4ESOS1EIF4EBP1CFTRMAPT
SCHEMBL21813966 0.76 KDM4E (0.52) KDM4EEIF4EBP1CFTRMAPT
SCHEMBL30845432 0.73 UGT8 (0.43) NOTUM
SCHEMBL21813648 0.73 UGT8 (0.43) NOTUM
SCHEMBL29559836 0.72 NQO2 (0.39) KDM4EMAPTSMN1; SMN2NPC1NFKB1
SCHEMBL19554465 0.72 KDM4E (0.43) KDM4EMAPTSMN1; SMN2NPC1NFKB1
SCHEMBL27319832 0.72 NQO2 (0.39) KDM4EMAPTSMN1; SMN2NPC1NFKB1

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
CN-113423711-B Thieno [3,2-B ] pyridine derivatives as UDP glycosyltransferase inhibitors and methods of use thereof 建新公司 2024-03-15 — — CN disclosed
US-20200102324-A1 UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE GENZYME CORPORATION 2020-04-02 — — US 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 KDM4E 647/4885SOS1 4584/4885EIF4EBP1 2940/4885

“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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