SCHEMBL6160624

SCHEMBL6160624

CO[C@@H]1[C@@H](O)[C@@H](O)[C@H](Oc2ccc3c(OS(=O)(=O)c4ccc(C)cc4)cc(=O)oc3c2C)OC1(C)C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 8/20 0.47
HSP90AA1 P07900 7/20 0.47
ALPL P05186 3/20 0.40
ALPI P09923 2/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40
KDM4E B2RXH2 1/20 0.40
POLQ O75417 1/20 0.40
ALB P02768 1/20 0.40
KDR P35968 1/20 0.40
MAP1LC3B Q9GZQ8 1/20 0.40
MAP1LC3A Q9H492 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40

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
SCHEMBL6156108 0.79 HSP90AB1 (0.49) HSP90AB1HSP90AA1KMT2ALMNAKDM4E
SCHEMBL6156284 0.79 ALPL (0.37) HSP90AB1HSP90AA1ALPLALPIKMT2A
SCHEMBL6867189 0.79 KDM4E (0.51) HSP90AB1HSP90AA1KMT2ALMNAKDM4E
SCHEMBL6867185 0.79 KDM4E (0.51) HSP90AB1HSP90AA1KMT2ALMNAKDM4E
SCHEMBL6938071 0.79 HSP90AB1 (0.46) HSP90AB1HSP90AA1KMT2AKDM4EPOLQ
SCHEMBL7743197 0.76 HSP90AB1 (0.47) HSP90AB1HSP90AA1KMT2AKDM4EPOLQ
SCHEMBL6866074 0.73 HSP90AB1 (0.54) HSP90AB1HSP90AA1LMNAKDM4EPOLQ
SCHEMBL6866071 0.73 HSP90AB1 (0.54) HSP90AB1HSP90AA1LMNAKDM4EPOLQ
SCHEMBL6156470 0.73 HSP90AB1 (0.43) HSP90AB1HSP90AA1KMT2AKDM4EPOLQ
SCHEMBL6156465 0.73 HSP90AB1 (0.43) HSP90AB1HSP90AA1KMT2AKDM4EPOLQ

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-0894805-B1 Ribose substituted aromatic derivatives, their preparation and use as medicaments AVENTIS PHARMA SA (FR) 2005-02-09 EP disclosed