SCHEMBL9689038

SCHEMBL9689038

CC(C)(C)[Si](OC[C@@H]1C=C[C@H](n2cnc3c(O)ncnc32)O1)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.39
ADORA1 P30542 2/20 0.38
DUT P33316 1/20 0.37
TYMP P19971 1/20 0.35
SLC29A1 Q99808 4/20 0.35
NT5E P21589 1/20 0.34
LMNA P02545 2/20 0.33
DNPH1 O43598 2/20 0.33
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
PMP22 Q01453 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPC1 O15118 1/20 0.33
NPY1R P25929 1/20 0.33
HTT P42858 1/20 0.33
NPY2R P49146 1/20 0.33
RAB9A P51151 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL9223633 0.85 DUT (0.48) BCHEADORA1DUTADORA3
SCHEMBL9687934 0.79 SLC29A1 (0.43) BCHESLC29A1DNPH1ADORA3AHCY
SCHEMBL9688659 0.78 GAA (0.43) ADORA1TYMPSLC29A1P2RY12
SCHEMBL2955999 0.76 BCHE (0.42) BCHELMNAALDH1A1ADORA3AHCY
SCHEMBL13238881 0.74 EGFR (0.41) BCHEADORA1SLC29A1LMNAALDH1A1
SCHEMBL1140703 0.74 EGFR (0.41) BCHEADORA1SLC29A1LMNAALDH1A1
SCHEMBL2045673 0.74 EGFR (0.41) BCHEADORA1SLC29A1LMNAALDH1A1
SCHEMBL6880733 0.74 ADK (0.44) BCHEADORA1DUT
SCHEMBL2950104 0.73 EGFR (0.40) BCHEADORA1SLC29A1LMNAALDH1A1
SCHEMBL2950100 0.73 EGFR (0.40) BCHEADORA1SLC29A1LMNAALDH1A1

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-0493602-A1 PROCESS FOR PRODUCING 2',3'-DIDEOXY-2',3'-DIDEHYDRONUCLEOSIDE YUKI GOSEI KOGYO CO., LTD. (JP) 1992-07-08 EP disclosed