SCHEMBL8058699

SCHEMBL8058699

Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](COC(=O)CS)O1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.64
ENPP1 P22413 3/20 0.63
P2RY1 P47900 2/20 0.63
HIF1A Q16665 1/20 0.50
NT5E P21589 1/20 0.49
PDE4D Q08499 2/20 0.49
PDE3A Q14432 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
DNPH1 O43598 1/20 0.49
PRKAB2 O43741 1/20 0.49
TRPM2 O94759 1/20 0.49
LDHA P00338 1/20 0.49
ADRB2 P07550 1/20 0.49
FBP1 P09467 1/20 0.49
SRC P12931 1/20 0.49
ADORA1 P30542 1/20 0.49
P2RY2 P41231 1/20 0.49
PRKAG1 P54619 1/20 0.49
PRKAA2 P54646 1/20 0.49
KCNH2 Q12809 1/20 0.49

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
SCHEMBL1889395 0.92 POLB (0.64) POLBENPP1P2RY1HIF1ANT5E
SCHEMBL2691352 0.90 POLB (0.62) POLBENPP1P2RY1HIF1ANT5E
SCHEMBL8623380 0.89 POLB (0.65) POLBENPP1P2RY1HIF1ANT5E
SCHEMBL3259692 0.89 POLB (0.65) POLBENPP1P2RY1HIF1ANT5E
SCHEMBL5369306 0.88 POLB (0.59) POLBENPP1P2RY1HIF1AAHCY
SCHEMBL3470715 0.87 POLB (0.63) POLBENPP1P2RY1HIF1ANT5E
SCHEMBL6833492 0.87 POLB (0.66) POLBENPP1P2RY1HIF1ANT5E
SCHEMBL7133529 0.87 POLB (0.59) POLBENPP1P2RY1HIF1ANT5E
SCHEMBL15798579 0.86 POLB (0.67) POLBENPP1P2RY1HIF1ANT5E
SCHEMBL8811716 0.86 POLB (0.67) POLBENPP1P2RY1HIF1ANT5E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1019535-A2 HIGHLY SENSITIVE MULTIMERIC NUCLEIC ACID PROBES THE UNIVERSITY OF ROCHESTER (US) 2000-07-19 EP disclosed
EP-0977839-A1 CIRCULAR DNA VECTORS FOR SYNTHESIS OF RNA AND DNA University of Rochester (US) 2000-02-09 EP disclosed
WO-1999009216-A9 HIGHLY SENSITIVE MULTIMERIC NUCLEIC ACID PROBES UNIV ROCHESTER (US) 1999-08-05 WO disclosed
WO-1999009216-A2 HIGHLY SENSITIVE MULTIMERIC NUCLEIC ACID PROBES UNIVERSITY OF ROCHESTER (US) 1999-02-25 WO disclosed
WO-1998038300-A1 CIRCULAR DNA VECTORS FOR SYNTHESIS OF RNA AND DNA UNIVERSITY OF ROCHESTER (US) 1998-09-03 WO disclosed