SCHEMBL9216504

SCHEMBL9216504

CC(C)(C)[Si](C)(C)OC[C@H]1C=C[C@@H](n2ccc(=O)[nH]c2=O)O1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DUT P33316 3/20 1.00
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
ALB P02768 1/20 0.39
POLB P06746 1/20 0.39
ADRA1A P35348 1/20 0.39
BLM P54132 1/20 0.39
TOP2A P11388 4/20 0.37
P2RY14 Q15391 1/20 0.37
SLC28A1 O00337 1/20 0.37
SLC28A2 O43868 1/20 0.37
SLC29A1 Q99808 1/20 0.37
SLC28A3 Q9HAS3 1/20 0.37
BCHE P06276 5/20 0.36
P2RY6 Q15077 3/20 0.36
P2RY2 P41231 4/20 0.35
P2RY4 P51582 1/20 0.35

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
SCHEMBL13444835 0.85 DUT (0.74) DUTALDH1A1LMNAALBPOLB
SCHEMBL9223713 0.81 DUT (0.69) DUTALDH1A1LMNAALBPOLB
SCHEMBL30976639 0.81 DUT (0.67) DUTALDH1A1LMNAALBPOLB
SCHEMBL13444856 0.81 DUT (0.67) DUTALDH1A1LMNAALBPOLB
SCHEMBL19927650 0.79 DUT (0.65) DUTP2RY14SLC28A1SLC28A2SLC29A1
SCHEMBL5963993 0.79 DUT (0.65) DUTTOP2AP2RY14SLC28A1SLC28A2
SCHEMBL26133880 0.79 DUT (0.65) DUTP2RY14SLC28A1SLC28A2SLC29A1
SCHEMBL1879258 0.79 DUT (0.65) DUTALDH1A1LMNAALBPOLB
SCHEMBL1879256 0.79 DUT (0.65) DUTALDH1A1LMNAALBPOLB
SCHEMBL8540687 0.78 DUT (0.64) DUTALDH1A1LMNAALBPOLB

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
US-5455339-A Method for the preparation of 2',3'-dideoxy and 2',3'-dideoxydide-hydro nucleosides UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1995-10-03 US disclosed