SCHEMBL21524778

SCHEMBL21524778

CC(Cc1cnc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)c(F)c1)CC(C)(C)c1cc2c(=O)[nH]c(N)nc2[nH]1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FOLR1 P15328 15/20 0.66
▸ GART P22102 14/20 0.66
▸ FOLR2 P14207 13/20 0.66
▸ SLC46A1 Q96NT5 13/20 0.66
▸ SLC19A1 P41440 8/20 0.66
▸ FPR2 P25090 2/20 0.52
▸ MTHFD1 P11586 1/20 0.52
▸ MTHFD2 P13995 1/20 0.52

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
SCHEMBL18552513 0.89 GART (0.73) FOLR1GARTFOLR2SLC46A1SLC19A1
SCHEMBL18540790 0.81 GART (0.91) FOLR1GARTFOLR2SLC46A1SLC19A1
SCHEMBL23732323 0.75 FOLR2 (0.54) FOLR1GARTFOLR2SLC46A1SLC19A1
SCHEMBL18540805 0.75 GART (0.77) FOLR1GARTFOLR2SLC46A1SLC19A1
SCHEMBL23732707 0.72 FOLR1 (0.68) FOLR1GARTFOLR2SLC46A1SLC19A1
SCHEMBL18551660 0.71 FOLR2 (0.55) FOLR1GARTFOLR2SLC46A1SLC19A1
SCHEMBL21494689 0.69 FPR2 (1.00) FOLR1GARTFOLR2SLC46A1SLC19A1
SCHEMBL21494691 0.69 FPR2 (1.00) FOLR1GARTFOLR2SLC46A1SLC19A1
SCHEMBL30106787 0.69 FPR2 (1.00) FOLR1GARTFOLR2SLC46A1SLC19A1
SCHEMBL23005217 0.69 FPR2 (0.57) FOLR1GARTFOLR2SLC46A1SLC19A1

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-10457688-B2 Monocyclic thieno, pyrido, and pyrrolo pyrimidine compounds and methods of use and manufacture of same DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2019-10-29 — — 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-10457688-B2 Monocyclic thieno, pyrido, and pyrrolo pyrimidine compounds and methods of use and manufacture of same DPYD, TPX2, TYMS FOLR1 147/4885GART 56/4885FOLR2 142/4885

“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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