SCHEMBL9810751

SCHEMBL9810751

Cc1cn([C@@H]2O[C@H](CNC(=O)c3ccccc3[N+](=O)[O-])C(O)C2O)c(=O)[nH]c1=O

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 2/20 0.43
PYGM P11217 1/20 0.42

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
SCHEMBL9810756 0.85 P2RY2 (0.45) P2RY2PYGM
SCHEMBL9780999 0.84
SCHEMBL9781006 0.84
SCHEMBL9810760 0.84 P2RY2 (0.44) P2RY2PYGM
SCHEMBL9810807 0.83 P2RY2 (0.49) P2RY2PYGM
SCHEMBL9810803 0.79 KDM4E (0.44) P2RY2PYGM
SCHEMBL9810750 0.78 PYGM (0.51) P2RY2PYGM
SCHEMBL9810782 0.78 PYGM (0.46) P2RY2PYGM
SCHEMBL7644590 0.77 DNPH1 (0.42) P2RY2
SCHEMBL7644912 0.76 DNPH1 (0.41) P2RY2

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-0257378-B1 PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THESE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1991-07-03 EP claimed
EP-0257378-B1 PYRIMIDINE DERIVATIVES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THESE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1991-07-03 EP disclosed