SCHEMBL1398653

SCHEMBL1398653

O=C(O)c1cc(=O)[nH]c(=O)n1[C@@H]1O[C@H](COP(=O)(O)C(=O)O)[C@@H](O)[C@H]1O

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 8/20 0.54
UMPS P11172 4/20 0.51
P2RY6 Q15077 6/20 0.48
P2RY4 P51582 3/20 0.48
P2RY14 Q15391 3/20 0.47
P2RX3 P56373 1/20 0.46
DNPH1 O43598 1/20 0.45

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
Orotidine Monophosphate SCHEMBL12727823 0.92 P2RY2 (0.58) P2RY2UMPSP2RY6P2RY4P2RY14
Orotidine Monophosphate SCHEMBL21891 0.92 P2RY2 (0.58) P2RY2UMPSP2RY6P2RY4P2RY14
Orotidine Monophosphate SCHEMBL20266267 0.91 P2RY2 (0.57) P2RY2UMPSP2RY6P2RY4P2RY14
Orotidine Monophosphate SCHEMBL30969958 0.91 P2RY2 (0.57) P2RY2UMPSP2RY6P2RY4P2RY14
SCHEMBL18453338 0.88 P2RY2 (0.70) P2RY2P2RY6P2RY4P2RY14P2RX3
SCHEMBL3514478 0.86 P2RY2 (0.73) P2RY2P2RY6P2RY4P2RY14P2RX3
Phosphoric Acid SCHEMBL21890 0.84 SLC28A1 (0.50) P2RY2P2RY6P2RY4P2RY14
Phosphoric Acid SCHEMBL3514477 0.84 SLC28A1 (0.50) P2RY2P2RY6P2RY4P2RY14
SCHEMBL20894 0.81 SLC28A1 (0.54) P2RY2
SCHEMBL20895 0.81 SLC28A1 (0.54) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2004826-B1 IMPROVED METHOD FOR HOMOLOGOUS RECOMBINATION IN EUKARYOTIC CELLS DSM IP ASSETS BV (NL) 2011-03-02 EP claimed