SCHEMBL8670080

SCHEMBL8670080

CC[C@H](C)[C@H](N)C(=O)OC[C@H]1O[C@@H](n2cc(F)c(N)nc2=O)C(O)C1O

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ IARS1 P41252 7/20 0.45
▸ HINT1 P49773 1/20 0.41
▸ LMNA P02545 1/20 0.41

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
SCHEMBL4880873 0.84 LMNA (0.43) HINT1LMNA
SCHEMBL8670073 0.82 ALB (0.39) IARS1LMNA
Hydrochloric Acid SCHEMBL9638073 0.81 P2RY6 (0.55) IARS1LMNA
Hydrochloric Acid SCHEMBL9638065 0.81 P2RY6 (0.55) IARS1LMNA
SCHEMBL2550066 0.81 ADK (0.51) LMNA
SCHEMBL23762553 0.80 P2RY6 (0.51) IARS1LMNA
SCHEMBL22387094 0.80 P2RY6 (0.51) IARS1LMNA
SCHEMBL22387174 0.80 P2RY6 (0.51) IARS1LMNA
SCHEMBL17165637 0.78 P2RY6 (0.47) IARS1
SCHEMBL17165639 0.78 P2RY6 (0.47) IARS1

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-5783689-A Antibacterial and antifungal nucleosides UNIVERSITY OF NOTRE DAME (US) 1998-07-21 — — US disclosed
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