SCHEMBL21756756

SCHEMBL21756756

Nc1ccn(C[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)CC2(F)F)c(=O)n1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ POLG P54098 3/20 0.50
▸ POLB P06746 1/20 0.42
▸ P2RY2 P41231 5/20 0.42
▸ P2RY6 Q15077 4/20 0.41
▸ P2RY4 P51582 2/20 0.41
▸ FGFR1 P11362 2/20 0.40
▸ POLA1 P09884 2/20 0.39
▸ P2RY12 Q9H244 2/20 0.37

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
SCHEMBL22508617 0.84 POLG (0.58) POLGPOLBP2RY2P2RY6P2RY4
SCHEMBL20879410 0.81 POLG (0.59) POLGPOLBP2RY2P2RY6P2RY4
SCHEMBL18840676 0.81 POLG (0.59) POLGPOLBP2RY2P2RY6P2RY4
SCHEMBL20018627 0.81 PDE3A (0.46) POLGPOLBFGFR1POLA1
SCHEMBL22475057 0.77 POLG (0.54) POLGPOLBP2RY2P2RY6P2RY4
SCHEMBL20417774 0.76 POLG (0.53) POLGPOLBP2RY2P2RY6P2RY4
SCHEMBL20879524 0.76 POLG (0.55) POLGPOLBP2RY2P2RY6P2RY4
SCHEMBL19934321 0.75 POLG (0.52) POLGPOLBP2RY2P2RY6P2RY4
SCHEMBL22474997 0.75 POLG (0.58) POLGPOLBP2RY2P2RY6P2RY4
SCHEMBL23171242 0.74 POLG (0.60) POLGPOLBP2RY2P2RY6P2RY4

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
WO-2020041051-A1 GEMCITABINE PRODRUGS CURE BIOPHARMA INC. (US) 2020-02-27 — — WO disclosed
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