SCHEMBL8613676

SCHEMBL8613676

Nc1ccn([C@H]2C[C@H](O)[C@@H](COP(=O)(O)O[C@H]3C[C@H](n4cnc5c(=O)[nH]c(N)nc54)O[C@@H]3CO)O2)c(=O)n1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 4/20 0.62
▸ P2RY4 P51582 4/20 0.62
▸ P2RY6 Q15077 3/20 0.62
▸ POLB P06746 3/20 0.62
▸ F2 P00734 2/20 0.56
▸ FUT5 Q11128 1/20 0.52
▸ TGM2 P21980 1/20 0.47
▸ NT5E P21589 2/20 0.46
▸ TERT O14746 1/20 0.45
▸ KRAS P01116 2/20 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
SCHEMBL8614074 1.00 P2RY2 (0.62) P2RY2P2RY4P2RY6POLBF2
SCHEMBL29365163 0.99 P2RY2 (0.61) P2RY2P2RY4P2RY6POLBF2
SCHEMBL29551697 0.99 P2RY2 (0.61) P2RY2P2RY4P2RY6POLBF2
SCHEMBL29424735 0.95 P2RY2 (0.62) P2RY2P2RY4P2RY6POLBF2
SCHEMBL4078522 0.95 P2RY2 (0.62) P2RY2P2RY4P2RY6POLBF2
SCHEMBL29365434 0.95 P2RY2 (0.62) P2RY2P2RY4P2RY6POLBF2
SCHEMBL29702417 0.95 P2RY2 (0.62) P2RY2P2RY4P2RY6POLBF2
SCHEMBL29371610 0.95 P2RY2 (0.62) P2RY2P2RY4P2RY6POLBF2
SCHEMBL31276800 0.94 P2RY2 (0.56) P2RY2P2RY4P2RY6POLBF2
SCHEMBL29567368 0.94 P2RY2 (0.56) P2RY2P2RY4P2RY6POLBF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5721350-A Deuterated nucleosides CHATTOPADHYAYA JYOTI (SE) 1998-02-24 — — US disclosed
EP-0648220-A1 DEUTERATED NUCLEOSIDES CHATTOPADHYAYA, Jyoti (SE) 1995-04-19 — — EP disclosed
WO-1993025566-A1 DEUTERATED NUCLEOSIDES CHATTOPADHYAYA JYOTI (SE) 1993-12-23 — — WO disclosed
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