SCHEMBL6156007

SCHEMBL6156007

Cc1c(O[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)ccc2c(O)cc(=O)oc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.45
CA12 O43570 3/20 0.44
CA9 Q16790 3/20 0.44
TNF P01375 1/20 0.44
NOD2 Q9HC29 1/20 0.44
NOD1 Q9Y239 1/20 0.44
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 8/20 0.42
HPGD P15428 6/20 0.42
ALDH1A1 P00352 5/20 0.42
HSD17B10 Q99714 3/20 0.42
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PSMD14 O00487 1/20 0.42
MMP2 P08253 1/20 0.42
BLM P54132 1/20 0.42
MAOB P27338 1/20 0.41
MET P08581 1/20 0.41
MEN1 O00255 1/20 0.41
GLA P06280 2/20 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
SCHEMBL6155934 0.82 MAOB (0.43) HSP90AA1KMT2AKDM4EHPGDALDH1A1
SCHEMBL6158795 0.81 HPGD (0.42) HSP90AA1CA12CA9TNFNOD2
SCHEMBL6156963 0.80 PDE3B (0.45)
SCHEMBL8442563 0.75 HPGD (0.72) KMT2AKDM4EHPGDALDH1A1HSD17B10
SCHEMBL8441390 0.74 KDM4E (0.63) HSP90AA1CA9KDM4EHPGDALDH1A1
SCHEMBL19019865 0.71 KDM4E (0.53) HSP90AA1CA12CA9TNFNOD2
SCHEMBL8440353 0.70 KDM4E (0.57) CA12CA9TNFNOD2NOD1
SCHEMBL19019871 0.70 KDM4E (0.51) HSP90AA1CA12CA9TNFNOD2
SCHEMBL5345045 0.70 MAOB (0.77) CA12CA9TNFNOD2NOD1
SCHEMBL7698624 0.68 TSHR (0.44) KDM4EHPGDALDH1A1HSD17B10TSHR

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 3 patents. 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
US-5968939-A ANTIBIOTICS FROM AMINOOXOBENZOPYRAN COMPOUNDS HOECHST MARION ROUSSEL (FR) 1999-10-19 US disclosed
EP-0894805-A1 Ribose substituted aromatic derivatives, their preparation and use as medicaments HOECHST MARION ROUSSEL (FR) 1999-02-03 EP disclosed