SCHEMBL8196752

SCHEMBL8196752

NCCCCNc1nc2nc[nH]c2c(=O)[nH]1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
XDH P47989 3/20 0.76
GDA Q9Y2T3 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
SCHEMBL16197989 0.99 XDH (0.77) XDHGDA
SCHEMBL17274775 0.96 XDH (0.76) XDHGDA
SCHEMBL9806979 0.90 XDH (0.71) XDHGDA
SCHEMBL5935074 0.90 XDH (0.78) XDHGDA
SCHEMBL249649 0.86 XDH (1.00) XDHGDA
SCHEMBL4384744 0.85 XDH (1.00) XDHGDA
SCHEMBL27959660 0.85 XDH (0.77) XDHGDA
SCHEMBL8535457 0.85 XDH (1.00) XDHGDA
SCHEMBL6272738 0.85 XDH (1.00) XDHGDA
Hydrochloric Acid SCHEMBL258899 0.84 XDH (0.97) XDHGDA

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
EP-0912751-B1 PROCESS FOR PREPARATION OF D-PROLINE DERIVATIVES BY MEANS OF MICRO-ORGANISMS LONZA AG (CH) 2000-10-04 EP disclosed
EP-0912751-A1 PROCESS FOR PREPARATION OF D-PROLINE DERIVATIVES BY MEANS OF MICRO-ORGANISMS LONZA AG (CH) 1999-05-06 EP disclosed
WO-1998001577-A1 PROCESS FOR PREPARATION OF D-PROLINE DERIVATIVES BY MEANS OF MICRO-ORGANISMS LONZA AG (CH) 1998-01-15 WO disclosed