SCHEMBL6188463

SCHEMBL6188463

C=C(NC(=O)C(C)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL11229697 0.83 GAA (0.33) MEN1KMT2A
SCHEMBL11309108 0.79 SLC15A1 (0.41)
SCHEMBL9400688 0.79 ATM (0.39)
SCHEMBL15080636 0.76
SCHEMBL12801402 0.75
SCHEMBL7204043 0.74
SCHEMBL1593747 0.71 MEN1 (0.38) TP53MEN1KMT2A
SCHEMBL11304900 0.71 SLC7A5 (0.50)
SCHEMBL6517566 0.69
SCHEMBL346338 0.69

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-1532128-A1 INHIBITORS OF HCV NS5B POLYMERASE Pharmacia & Upjohn Company LLC (US) 2005-05-25 EP disclosed
WO-2004002977-A1 INHIBITORS OF HCV NS5B POLYMERASE PHARMACIA & UPJOHN COMPANY LLC (US) 2004-01-08 WO disclosed