SCHEMBL7526552

SCHEMBL7526552

Nc1nc2c(c(=O)[nH]1)N=C(CNC1=CCC(C(=O)NC(CCC(=O)O)C(=O)O)C=C1)CN2

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GART P22102 9/20 0.44
▸ SOST Q9BQB4 1/20 0.44
▸ MTHFD2 P13995 2/20 0.43
▸ MTHFD1 P11586 2/20 0.43
▸ ATIC P31939 3/20 0.42
▸ DHFR P00374 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
SCHEMBL29962321 0.82 GART (0.46) GARTSOSTMTHFD2MTHFD1ATIC
Dihydrofolic Acid SCHEMBL7522026 0.81 TYMS (0.66) GARTSOSTMTHFD2MTHFD1ATIC
Dihydrofolic Acid SCHEMBL12136386 0.81 SOST (0.61) GARTSOSTMTHFD2MTHFD1ATIC
Dihydrofolic Acid SCHEMBL27589172 0.81 SOST (0.61) GARTSOSTMTHFD2MTHFD1ATIC
Dihydrofolic Acid SCHEMBL8281 0.81 SOST (0.61) GARTSOSTMTHFD2MTHFD1ATIC
Dihydrofolic Acid SCHEMBL8282 0.81 SOST (0.61) GARTSOSTMTHFD2MTHFD1ATIC
Dihydrofolic Acid SCHEMBL27415499 0.80 SOST (0.60) GARTSOSTMTHFD2MTHFD1ATIC
Dihydrofolic Acid SCHEMBL27779274 0.79 SOST (0.60) GARTSOSTMTHFD2MTHFD1ATIC
SCHEMBL4616964 0.79 MTHFD1 (0.47) GARTSOSTMTHFD2MTHFD1ATIC
SCHEMBL29619286 0.77 TYMS (0.66) GARTATICDHFR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1244789-A2 GENES IDENTIFIED AS REQUIRED FOR PROLIFERATION OF E. COLI Elitra Pharmaceuticals, Inc. (US) 2002-10-02 — — EP disclosed
WO-2002010442-A1 USE OF ECTOENZYMES AND SECRETED ENZYMES TO MONITOR CELLULAR PROLIFERATION ELITRA PHARMACEUTICALS, INC. (US) 2002-02-07 — — WO disclosed
EP-1149166-A2 GENES IDENTIFIED AS REQUIRED FOR PROLIFERATION IN $i(ESCHERICHIA COLI) Elitra Pharmaceuticals, Inc. (US) 2001-10-31 — — EP disclosed
WO-2001048209-A2 GENES IDENTIFIED AS REQUIRED FOR PROLIFERATION OF E. COLI ELITRA PHARMACEUTICALS, INC. (US) 2001-07-05 — — WO disclosed
WO-2001034810-A2 GENES ESSENTIAL FOR MICROBIAL PROLIFERATION ELITRA PHARMACEUTICALS, INC. (US) 2001-05-17 — — WO disclosed
WO-2000044906-A2 GENES IDENTIFIED AS REQUIRED FOR PROLIFERATION IN $i(ESCHERICHIA COLI) ELITRA PHARMACEUTICALS, INC. (US) 2000-08-03 — — WO disclosed
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