SCHEMBL22024013

SCHEMBL22024013

CC(=O)NC1C(O)C(O)[C@H](CO)O[C@@H]1O[C@@H]1O[C@H](C[C@@H](O)[C@@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)C(O)C(O)C1NC(C)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ P2RY14 Q15391 5/20 0.61
▸ P2RY2 P41231 5/20 0.60
▸ P2RY6 Q15077 5/20 0.60
▸ P2RY4 P51582 4/20 0.60
▸ SLC28A1 O00337 1/20 0.54
▸ SLC28A2 O43868 1/20 0.54
▸ SLC29A1 Q99808 1/20 0.54
▸ SLC28A3 Q9HAS3 1/20 0.54
▸ OGT O15294 2/20 0.54
▸ MEN1 O00255 1/20 0.52
▸ APEX1 P27695 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ MAPT P10636 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL20415965 1.00 P2RY14 (0.61) P2RY14P2RY2P2RY6P2RY4SLC28A1
SCHEMBL24092376 1.00 P2RY14 (0.61) P2RY14P2RY2P2RY6P2RY4SLC28A1
SCHEMBL20415979 0.95 P2RY14 (0.56) P2RY14P2RY2P2RY6P2RY4SLC28A1
SCHEMBL29496224 0.95 P2RY14 (0.56) P2RY14P2RY2P2RY6P2RY4SLC28A1
SCHEMBL30438116 0.91 MEN1 (0.59) P2RY14P2RY2P2RY6P2RY4SLC28A1
SCHEMBL25269457 0.91 MEN1 (0.59) P2RY14P2RY2P2RY6P2RY4SLC28A1
SCHEMBL13210232 0.91 MEN1 (0.59) P2RY14P2RY2P2RY6P2RY4SLC28A1
SCHEMBL21597948 0.91 MEN1 (0.57) P2RY14P2RY2P2RY6P2RY4SLC28A1
SCHEMBL3738697 0.91 MEN1 (0.59) P2RY14P2RY2P2RY6P2RY4SLC28A1
SCHEMBL25251763 0.91 MEN1 (0.59) P2RY14P2RY2P2RY6P2RY4SLC28A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954262-B2 Tunicamycin analogues OXFORD UNIVERSITY INNOVATION LIMITED 2021-03-23 — — US disclosed
US-20200165286-A1 TUNICAMYCIN ANALOGUES OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2020-05-28 — — 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 (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-20200165286-A1 TUNICAMYCIN ANALOGUES HSPA5, TMSB10, ERP29 P2RY14 4345/4885P2RY2 4117/4885P2RY6 3699/4885
US-10954262-B2 Tunicamycin analogues HSPA5, TMSB10, ERP29 P2RY14 4345/4885P2RY2 4117/4885P2RY6 3699/4885

“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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