SCHEMBL17833859

SCHEMBL17833859

CC(CSSc1ccccn1)OC(=O)Nc1nc2c(ncn2C2CC(O)C(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.47
▸ P2RY2 P41231 2/20 0.47
▸ P2RY6 Q15077 2/20 0.47
▸ P2RY4 P51582 1/20 0.47
▸ TAS1R3 Q7RTX0 2/20 0.45
▸ TAS1R1 Q7RTX1 2/20 0.45
▸ POLA1 P09884 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ DTYMK P23919 4/20 0.40
▸ TYMP P19971 1/20 0.39
▸ KRAS P01116 2/20 0.38
▸ FUT5 Q11128 1/20 0.38
▸ GPR17 Q13304 1/20 0.38
▸ P2RY1 P47900 1/20 0.37
▸ P2RY12 Q9H244 1/20 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
SCHEMBL12729600 0.89 POLA1 (0.52) TAS1R3TAS1R1POLA1KDM4ETYMP
SCHEMBL12729574 0.87 P2RY12 (0.50) POLBP2RY2P2RY6DTYMKGPR17
SCHEMBL12729503 0.86 POLB (0.54) POLBP2RY2P2RY6P2RY4TAS1R3
SCHEMBL17833857 0.83 P2RY6 (0.43) POLBP2RY2P2RY6P2RY4DTYMK
SCHEMBL29577651 0.81 TAS1R3 (0.66) POLBP2RY2P2RY6P2RY4TAS1R3
SCHEMBL207004 0.78 POLB (0.63) POLBP2RY2P2RY6P2RY4TAS1R3
SCHEMBL17833843 0.78 POLB (0.54) POLBP2RY2P2RY6P2RY4TAS1R3
SCHEMBL12729456 0.77 POLB (0.54) POLBP2RY2P2RY6P2RY4TAS1R3
SCHEMBL12729601 0.77 KDM4E (0.39) TAS1R3TAS1R1POLA1KDM4E
SCHEMBL17833841 0.76 POLB (0.47) POLBP2RY2P2RY6P2RY4DTYMK

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
US-20160168636-A1 NUCLEOTIDE ANALOGS HELICOS BIOSCIENCES CORPORATION 2016-06-16 — — US disclosed
US-20160168636-A1 NUCLEOTIDE ANALOGS HELICOS BIOSCIENCES CORPORATION 2016-06-16 — — US disclosed
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