SCHEMBL7941541

SCHEMBL7941541

O=c1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])O2)c(=O)[nH]1.[I+4]

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
P2RY2 P41231 4/20 0.68
P2RY4 P51582 3/20 0.68
DUT P33316 4/20 0.66
P2RY6 Q15077 3/20 0.65
TYMS P04818 2/20 0.49

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
SCHEMBL6660054 0.99 P2RY2 (0.69) P2RY2P2RY4DUTP2RY6TYMS
SCHEMBL28327517 0.98 P2RY2 (0.68) P2RY2P2RY4DUTP2RY6TYMS
SCHEMBL30276232 0.93 DUT (0.68) P2RY2P2RY4DUTP2RY6TYMS
Deoxyuridine Monophosphate SCHEMBL20266308 0.89 DUT (0.71) P2RY2P2RY4DUTP2RY6TYMS
Deoxyuridine SCHEMBL29115607 0.87 DUT (0.59) P2RY2P2RY4DUTP2RY6
Deoxyuridine Monophosphate SCHEMBL25024676 0.85 DUT (0.77) DUTTYMS
Deoxyuridine Monophosphate SCHEMBL21941035 0.85 DUT (0.77) DUTTYMS
Deoxyuridine Monophosphate SCHEMBL888328 0.85 DUT (0.77) DUTTYMS
Deoxyuridine Monophosphate SCHEMBL8200 0.85 DUT (0.77) DUTTYMS
SCHEMBL9497573 0.83 POLB (0.56) TYMS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3230524-B2 2001-11-19 JP claimed
EP-0447442-B1 METHOD FOR POLYMERASE ACTIVITY DETERMINATION KAELLANDER CLAS FREDRIK RUNESS (SE) 1994-09-21 EP claimed
EP-0447442-A1 METHOD FOR POLYMERASE ACTIVITY DETERMINATION. KAELLANDER CLAS FREDRIK RUNESS (SE) 1991-09-25 EP claimed
WO-1990006320-A1 SUBSTRATE FOR POLYMERASE ACTIVITY DETERMINATION KAELLANDER CLAS FREDRIK RUNESS (SE) 1990-06-14 WO claimed
WO-1990006373-A1 METHOD FOR POLYMERASE ACTIVITY DETERMINATION KAELLANDER CLAS FREDRIK RUNESS (SE) 1990-06-14 WO claimed
EP-0447442-B1 METHOD FOR POLYMERASE ACTIVITY DETERMINATION KAELLANDER CLAS FREDRIK RUNESS (SE) 1994-09-21 EP disclosed
EP-0447442-A1 METHOD FOR POLYMERASE ACTIVITY DETERMINATION. KAELLANDER CLAS FREDRIK RUNESS (SE) 1991-09-25 EP disclosed
WO-1990006320-A1 SUBSTRATE FOR POLYMERASE ACTIVITY DETERMINATION KAELLANDER CLAS FREDRIK RUNESS (SE) 1990-06-14 WO disclosed
WO-1990006320-A1 SUBSTRATE FOR POLYMERASE ACTIVITY DETERMINATION KAELLANDER CLAS FREDRIK RUNESS (SE) 1990-06-14 WO disclosed
WO-1990006373-A1 METHOD FOR POLYMERASE ACTIVITY DETERMINATION KAELLANDER CLAS FREDRIK RUNESS (SE) 1990-06-14 WO disclosed