SCHEMBL22801236

SCHEMBL22801236

CCCO[PH]1(O)OC[C@H]2O[C@@H](n3cc(F)c(=O)[nH]c3=O)C[C@@H]2O1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ TK1 P04183 4/20 0.41
▸ DHFR P00374 1/20 0.41
▸ MAPT P10636 2/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ PMP22 Q01453 1/20 0.39
▸ HBB P68871 1/20 0.39
▸ TK2 O00142 1/20 0.38

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
SCHEMBL21178038 0.93 LMNA (0.45) LMNASMN1; SMN2TK1DHFRMAPT
SCHEMBL22801262 0.93 LMNA (0.45) LMNASMN1; SMN2TK1DHFRMAPT
SCHEMBL21178589 0.93 LMNA (0.45) LMNASMN1; SMN2TK1DHFRMAPT
SCHEMBL21179131 0.93 LMNA (0.45) LMNASMN1; SMN2TK1DHFRMAPT
SCHEMBL22801209 0.93 LMNA (0.45) LMNASMN1; SMN2TK1DHFRMAPT
SCHEMBL22801182 0.90 SMN1; SMN2 (0.41) LMNASMN1; SMN2TK1DHFRMAPT
SCHEMBL21178133 0.88 LMNA (0.45) LMNASMN1; SMN2TK1DHFRMAPT
SCHEMBL22801215 0.87 LMNA (0.45) LMNASMN1; SMN2DHFRMAPTESR1
SCHEMBL22801221 0.86 LMNA (0.43) LMNASMN1; SMN2TK1DHFRMAPT
SCHEMBL22801189 0.86 LMNA (0.47) LMNASMN1; SMN2TK1DHFRMAPT

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-11427550-B2 5-fluorouracil compounds NUCORION PHARMACEUTICALS, INC. (US) 2022-08-30 — — US disclosed
US-20200399227-A1 5-FLUOROURACIL COMPOUNDS NUCORION PHARMACEUTICALS, INC. 2020-12-24 — — 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-20200399227-A1 5-FLUOROURACIL COMPOUNDS DPYD, DHFR, FAU LMNA 1225/4885SMN1; SMN2 1144/4885TK1 1030/4885
US-11427550-B2 5-fluorouracil compounds DPYD, DHFR, MTHFD1 LMNA 1038/4885SMN1; SMN2 1251/4885TK1 964/4885

“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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