SCHEMBL5320623

SCHEMBL5320623

O=c1[nH]c(=S)ccn1[C@H]1CC[C@@H](COP(=O)(O)O)O1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ P2RY6 Q15077 4/20 0.49
▸ P2RY2 P41231 3/20 0.49
▸ P2RY4 P51582 3/20 0.49
▸ TK1 P04183 3/20 0.42
▸ DUT P33316 1/20 0.42
▸ P2RY14 Q15391 1/20 0.42
▸ TYMS P04818 4/20 0.40

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
SCHEMBL21346154 0.90 P2RY2 (0.59) P2RY6P2RY2P2RY4P2RY14
SCHEMBL29264470 0.88 DUT (0.53) P2RY6P2RY2P2RY4DUTP2RY14
SCHEMBL20879422 0.88 DUT (0.53) P2RY6P2RY2P2RY4DUTP2RY14
SCHEMBL533609 0.88 DUT (0.53) P2RY6P2RY2P2RY4DUTP2RY14
SCHEMBL14577732 0.82 ABL1 (0.45) P2RY6P2RY2P2RY4TK1P2RY14
SCHEMBL5317527 0.82 ABL1 (0.45) P2RY6P2RY2P2RY4TK1P2RY14
SCHEMBL5317524 0.82 ABL1 (0.45) P2RY6P2RY2P2RY4TK1P2RY14
SCHEMBL5317712 0.81 DUT (0.63) DUTTYMS
SCHEMBL7064249 0.81 DUT (0.63) DUTTYMS
SCHEMBL6913590 0.81 DUT (0.47) P2RY6P2RY2P2RY4DUTP2RY14

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-2007083173-A2 MONONUCLEOTIDES AND MONONUCLEOSIDES FOR USE IN THERAPY UNIVERSITY OF DEBRECEN (HU) 2007-07-26 — — WO disclosed
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