SCHEMBL4267963

SCHEMBL4267963

O=c1ccn([C@H]2C[C@H](O)[C@@H](C(F)(F)OP(=O)(O)O)O2)c(=O)[nH]1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ DUT P33316 4/20 0.52
▸ P2RY14 Q15391 1/20 0.45
▸ P2RY2 P41231 11/20 0.43
▸ P2RY6 Q15077 6/20 0.43
▸ P2RY4 P51582 3/20 0.41
▸ TYMS P04818 1/20 0.41

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
SCHEMBL425421 0.83 DUT (0.53) DUTP2RY14P2RY2P2RY6P2RY4
SCHEMBL3759571 0.78 POLB (0.55) P2RY2P2RY6P2RY4
Phosphoric Acid SCHEMBL7906605 0.76 DUT (0.55) DUTP2RY2P2RY6P2RY4
SCHEMBL475343 0.76 DUT (0.52) DUTP2RY2P2RY6P2RY4
Deoxyuridine Monophosphate SCHEMBL25024676 0.75 DUT (0.77) DUTTYMS
Deoxyuridine Monophosphate SCHEMBL888328 0.75 DUT (0.77) DUTTYMS
Deoxyuridine Monophosphate SCHEMBL8200 0.75 DUT (0.77) DUTTYMS
Deoxyuridine Monophosphate SCHEMBL21941035 0.75 DUT (0.77) DUTTYMS
SCHEMBL5051998 0.75 DUT (0.76) DUTP2RY2P2RY6P2RY4TYMS
Deoxyuridine SCHEMBL20585969 0.74 DUT (0.64) DUT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8388966-B2 Combination treatment of pancreatic cancer CANCER ADVANCES, INC. (US) 2013-03-05 — — US disclosed
US-20090004200-A1 Combination treatment of pancreatic cancer CANCER ADVANCES, INC. 2009-01-01 — — US disclosed
US-20060140962-A1 Combination treatment of pancreatic cancer CANCER ADVANCES, INC. 2006-06-29 — — US disclosed
EP-1372717-A2 COMBINATION TREATMENT OF PANCREATIC CANCER APHTON CORPORATION (US) 2004-01-02 — — EP disclosed
US-20030091574-A1 Combination treatment of pancreatic cancer CANCER ADVANCES, INC. 2003-05-15 — — US disclosed
WO-2002076499-A2 COMBINATION TREATMENT OF PANCREATIC CANCER APHTON CORPORATION (US) 2002-10-03 — — WO disclosed
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