SCHEMBL12865276

SCHEMBL12865276

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

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TK1 P04183 4/20 0.33
▸ LMNA P02545 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ CDA P32320 6/20 0.33
▸ ALB P02768 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ PMP22 Q01453 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
SCHEMBL17635427 1.00 TK1 (0.33) TK1LMNASMN1; SMN2CDAALB
SCHEMBL12865604 0.89 — —
SCHEMBL21560996 0.86 TK1 (0.44) TK1LMNASMN1; SMN2BLMPMP22
SCHEMBL19129852 0.83 RNASE1 (0.36) TK1CDAALBPKM
SCHEMBL17635428 0.83 CDA (0.33) TK1LMNASMN1; SMN2CDAALB
SCHEMBL19129669 0.75 RNASE1 (0.32) TK1
SCHEMBL20857203 0.73 TYMS (0.41) —
SCHEMBL14140654 0.72 — —
SCHEMBL13389793 0.72 — —
SCHEMBL13573838 0.72 TK1 (0.44) TK1LMNASMN1; SMN2BLMPMP22

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-20110039798-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES EASTERN VIRGINIA MEDICAL SCHOOL (US) 2011-02-17 — — 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-20110039798-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES SAMHD1, TLR3, MAVS TK1 156/4885LMNA 2320/4885SMN1; SMN2 2502/4885

“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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