SCHEMBL9675797

SCHEMBL9675797

CCOP(=O)(CSC(CO)COn1cnc2c(OC)nc(N)nc21)OCC

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 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
SCHEMBL9675785 1.00 HSP90AA1 (0.33) HSP90AA1HSP90AB1
SCHEMBL9555585 0.83 HSP90AA1 (0.34) HSP90AA1HSP90AB1
SCHEMBL9555553 0.83 HSP90AA1 (0.34) HSP90AA1HSP90AB1
SCHEMBL9555558 0.83 HSP90AA1 (0.34) HSP90AA1HSP90AB1
SCHEMBL9683352 0.82 HSP90AA1 (0.36) HSP90AA1HSP90AB1
SCHEMBL9677354 0.82 PNP (0.44)
SCHEMBL9675501 0.81 CYP3A4 (0.39)
SCHEMBL9685521 0.80 HSP90AA1 (0.35) HSP90AA1HSP90AB1
SCHEMBL9857620 0.80 HPRT1 (0.35) HSP90AA1HSP90AB1
SCHEMBL9184496 0.77 HSP90AB1 (0.42) HSP90AA1HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5108994-A Synergistic with interferon; herpes virus BEECHAM GROUP P.L.C. (GB) 1992-04-28 US disclosed
EP-0399743-A1 Phosphonomethylthio-alkoseypureine derivatives, intermediate products for their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1990-11-28 EP disclosed