SCHEMBL19389402

SCHEMBL19389402

COP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)CC1O

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.76
▸ P2RY2 P41231 1/20 0.68
▸ P2RY4 P51582 1/20 0.68
▸ P2RY6 Q15077 1/20 0.68
▸ FUT5 Q11128 1/20 0.56
▸ TGM2 P21980 1/20 0.56
▸ NT5E P21589 2/20 0.56
▸ KRAS P01116 2/20 0.53
▸ DTYMK P23919 2/20 0.51
▸ IMPDH2 P12268 1/20 0.51
▸ IMPDH1 P20839 1/20 0.51
▸ TAS1R3 Q7RTX0 2/20 0.49
▸ TAS1R1 Q7RTX1 2/20 0.49
▸ ENPP1 P22413 1/20 0.49
▸ P2RY1 P47900 1/20 0.49
▸ F2 P00734 1/20 0.48
▸ PNP P00491 1/20 0.48
▸ DCPS Q96C86 1/20 0.48

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
SCHEMBL18963993 0.96 POLB (0.75) POLBP2RY2P2RY4P2RY6FUT5
SCHEMBL24864701 0.96 POLB (0.75) POLBP2RY2P2RY4P2RY6FUT5
SCHEMBL24864699 0.96 POLB (0.75) POLBP2RY2P2RY4P2RY6FUT5
SCHEMBL21725237 0.95 POLB (0.69) POLBP2RY2P2RY4P2RY6FUT5
SCHEMBL22053475 0.95 POLB (0.81) POLBP2RY2P2RY4P2RY6FUT5
SCHEMBL20710403 0.95 POLB (0.81) POLBP2RY2P2RY4P2RY6FUT5
SCHEMBL20832619 0.95 POLB (0.81) POLBP2RY2P2RY4P2RY6FUT5
SCHEMBL18785152 0.92 POLB (0.82) POLBP2RY2P2RY4P2RY6FUT5
SCHEMBL18775385 0.92 POLB (0.82) POLBP2RY2P2RY4P2RY6FUT5
SCHEMBL2219689 0.92 POLB (0.82) POLBP2RY2P2RY4P2RY6FUT5

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
EP-2917341-B1 NEW PHOSPHODEOXYRIBOSYLTRANSFERASE MUTANT ENZYMES AND USES THEREOF CENTRE NAT DE LA RECH SCIENT (C N R S ) (FR) 2017-09-27 — — EP disclosed
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