SCHEMBL20869901

SCHEMBL20869901

CC(C)C(=O)Nc1nc2[nH]cc(CCc3ccc(COCO)cc3)c2c(=O)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TYMS P04818 18/20 0.41
DHFR P00374 4/20 0.41
FOLR1 P15328 2/20 0.41
SLC19A1 P41440 2/20 0.41
SLC46A1 Q96NT5 2/20 0.41
FOLR2 P14207 1/20 0.41
GART P22102 1/20 0.41
ATIC P31939 1/20 0.41
SHMT1 P34896 1/20 0.41
FRK P42685 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
SCHEMBL13658541 0.85 TYMS (0.49) TYMSDHFRFOLR1SLC19A1SLC46A1
SCHEMBL28690321 0.74 TYMS (0.51) TYMSDHFRFOLR1SLC19A1SLC46A1
SCHEMBL20064089 0.71 NOS1 (0.37) TYMS
SCHEMBL25476851 0.69 TYMS (0.64) TYMSDHFRFOLR1SLC19A1SLC46A1
SCHEMBL19901167 0.68 KMT2A (0.54)
SCHEMBL23394652 0.67 TYMS (0.63) TYMSDHFRFOLR1SLC19A1SLC46A1
SCHEMBL24845716 0.67 PNP (0.57) TYMSDHFRFOLR1SLC19A1SLC46A1
SCHEMBL8855177 0.67 TYMS (0.61) TYMSDHFRFOLR1SLC19A1SLC46A1
SCHEMBL22084411 0.67 TYMS (0.62) TYMSDHFRFOLR1SLC19A1SLC46A1
SCHEMBL13659935 0.66 TYMS (0.63) TYMSDHFRFOLR1SLC19A1SLC46A1

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-20190099493-A1 Targeting Lipids ARBUTUS BIOPHARMA CORPORATION (CA) 2019-04-04 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-20190099493-A1 Targeting Lipids APOB, LY96, ABHD10 TYMS 2545/4885DHFR 1469/4885FOLR1 484/4885

“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.