SCHEMBL17635428

SCHEMBL17635428

CC=C1NC(=O)N([C@H]2C[C@@H](F)[C@@H](CO)O2)C=C1C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CDA P32320 8/20 0.33
▸ TK1 P04183 4/20 0.32
▸ LMNA P02545 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ALB P02768 1/20 0.31
▸ PKM P14618 1/20 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
SCHEMBL17635427 0.83 TK1 (0.33) CDATK1LMNASMN1; SMN2ALB
SCHEMBL12865276 0.83 TK1 (0.33) CDATK1LMNASMN1; SMN2ALB
SCHEMBL12865604 0.72 — —
SCHEMBL21560996 0.70 TK1 (0.44) TK1LMNASMN1; SMN2
SCHEMBL19129852 0.67 RNASE1 (0.36) CDATK1ALBPKM
Alovudine SCHEMBL12296837 0.65 TK1 (0.68) TK1LMNAALBPKM
Alovudine SCHEMBL20769856 0.65 TK1 (0.68) TK1LMNAALBPKM
Alovudine SCHEMBL9849822 0.65 TK1 (0.68) TK1LMNAALBPKM
Alovudine SCHEMBL10380714 0.65 TK1 (0.68) TK1LMNAALBPKM
Alovudine SCHEMBL13020428 0.65 TK1 (0.68) TK1LMNAALBPKM

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-9296776-B2 Substituted nucleoside derivatives with antiviral and antimicrobial properties EASTERN VIRGINIA MEDICAL SCHOOL (US) 2016-03-29 — — US disclosed
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