SCHEMBL21410682

SCHEMBL21410682

NC(=O)OP(=O)(OC(N)=O)OC(=O)[C@@H](N)CC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CA4 P22748 3/20 0.35
▸ CA1 P00915 2/20 0.34
▸ CA5A P35218 2/20 0.34
▸ CA5B Q9Y2D0 2/20 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
SCHEMBL28664668 0.84 CA4 (0.39) CA4CA1CA5ACA5B
SCHEMBL4297049 0.79 CA4 (0.39) CA4
SCHEMBL1890700 0.79 FOLH1 (0.32) —
SCHEMBL771738 0.79 CA4 (0.39) CA4
SCHEMBL771739 0.79 CA4 (0.39) CA4
Aminocarbonyl Dihydrogen Phosphate SCHEMBL21410683 0.77 CA4 (0.50) CA4CA1CA5ACA5B
SCHEMBL1890693 0.77 FOLH1 (0.35) —
SCHEMBL28006119 0.77 CA4 (0.38) CA4
Phosphoramidic Acid SCHEMBL1691899 0.76 FOLH1 (0.34) —
Phosphoramidic Acid SCHEMBL13280710 0.76 FOLH1 (0.34) —

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
WO-2021189018-A9 METHODS OF TREATING VIRAL INFECTIONS USING INHIBITORS OF NUCLEOTIDE SYNTHESIS PATHWAYS Clear Creek Bio, Inc. (US) 2022-04-28 — — WO disclosed
EP-3773579-A1 COMPOSITIONS AND METHODS FOR INHIBITING DIHYDROOROTATE DEHYDROGENASE Clear Creek Bio, Inc. (US) 2021-02-17 — — EP disclosed
WO-2019191032-A1 COMPOSITIONS AND METHODS FOR INHIBITING DIHYDROOROTATE DEHYDROGENASE Clear Creek Bio, Inc. (US) 2019-10-03 — — WO disclosed
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