SCHEMBL16914966

SCHEMBL16914966

C=C(CC(=O)On1cc(C)c(=O)[nH]c1=O)C(=O)On1cc(C)c(=O)[nH]c1=O

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.38
▸ TYMP P19971 4/20 0.38
▸ TK1 P04183 3/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL22440027 0.87 MAPK1 (0.39) MAPK1TYMPTK1HPGD
SCHEMBL13724687 0.81 MAPK1 (0.43) MAPK1TYMPTK1HPGD
SCHEMBL2635616 0.76 MAPK1 (0.42) MAPK1TYMPTK1HPGD
SCHEMBL8910349 0.74 MAPK1 (0.41) MAPK1TYMPTK1HPGD
SCHEMBL28402505 0.74 TK1 (0.39) MAPK1TYMPTK1HPGD
SCHEMBL16485715 0.71 MAPK1 (0.47) MAPK1TYMPTK1HPGD
SCHEMBL8412383 0.70 TYMP (0.43) MAPK1TYMPTK1HPGD
SCHEMBL24052575 0.69 TK1 (0.55) MAPK1TK1HPGD
SCHEMBL16915037 0.68 TYMP (0.41) MAPK1TYMPTK1
SCHEMBL7643586 0.67 MAPK1 (0.51) MAPK1TYMPTK1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3094968-A1 METABOLIC SCREENING FOR GESTATIONAL DIABETES The Regents of The University of California (US) 2016-11-23 — — EP disclosed
WO-2015109116-A1 METABOLIC SCREENING FOR GESTATIONAL DIABETES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-07-23 — — WO disclosed
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