SCHEMBL21178129

SCHEMBL21178129

CCc1ccc(CN[PH]2(O)OC[C@H]3O[C@@H](n4cc(F)c(=O)[nH]c4=O)C[C@@H]3O2)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ DHFR P00374 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ ESR1 P03372 1/20 0.37
▸ TYMS P04818 1/20 0.37
▸ TSHR P16473 1/20 0.36
▸ PMP22 Q01453 1/20 0.36
▸ HBB P68871 1/20 0.36
▸ TK1 P04183 1/20 0.34

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
SCHEMBL21178575 0.83 LMNA (0.43) LMNASMN1; SMN2DHFRMAPTESR1
SCHEMBL22801199 0.82 LMNA (0.44) LMNASMN1; SMN2DHFRMAPTESR1
SCHEMBL21178130 0.78 DHFR (0.49) LMNASMN1; SMN2DHFRMAPTESR1
SCHEMBL21178693 0.78 DHFR (0.49) LMNASMN1; SMN2DHFRMAPTESR1
SCHEMBL21178694 0.78 DHFR (0.49) LMNASMN1; SMN2DHFRMAPTESR1
SCHEMBL22801236 0.75 LMNA (0.47) LMNASMN1; SMN2DHFRMAPTESR1
SCHEMBL21178897 0.75 LMNA (0.45) LMNASMN1; SMN2DHFRMAPTESR1
SCHEMBL22801247 0.73 LMNA (0.44) LMNASMN1; SMN2DHFRMAPTESR1
SCHEMBL21178057 0.73 LMNA (0.45) LMNASMN1; SMN2MAPTESR1TYMS
SCHEMBL22801192 0.72 LMNA (0.47) LMNASMN1; SMN2DHFRMAPTESR1

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 3 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
WO-2019143860-A1 5-FLUOROURACIL COMPOUNDS NUCORION PHARMACEUTICALS, INC. (US) 2019-07-25 — — WO 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 1144/4885DHFR 2/4885
US-11427550-B2 5-fluorouracil compounds DPYD, DHFR, MTHFD1 LMNA 1038/4885SMN1; SMN2 1251/4885DHFR 2/4885

“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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