SCHEMBL8309192

SCHEMBL8309192

CCCc1c(-c2cc(=O)c3c(OC)cc(OCC4=COC(C)(C)O4)cc3o2)ccc(OC)c1OC1OC(C(=O)OC)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39
USP2 O75604 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
RPS6KA3 P51812 2/20 0.33
BRD4 O60885 1/20 0.32
MAOA P21397 2/20 0.32
MAOB P27338 2/20 0.32
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL8306216 0.84 CYP3A4 (0.39) CYP3A4MEN1KMT2AKDM4EMAPT
SCHEMBL8306215 0.83 EPHX2 (0.45) CYP3A4MEN1KMT2AKDM4EMAPT
SCHEMBL8306597 0.82 ABCB1 (0.42) MEN1KMT2AKDM4EBRD4MAOA
SCHEMBL8304673 0.79 BRD4 (0.40) CYP3A4MEN1KMT2AKDM4EMAPT
SCHEMBL8431005 0.77 HPGD (0.50) CYP3A4MEN1KMT2AKDM4EMAPT
SCHEMBL8307532 0.77 L3MBTL1 (0.39) CYP3A4MEN1KMT2AKDM4EMAPT
SCHEMBL8306914 0.74 CYP1B1 (0.43) CYP3A4MEN1KMT2AMAPTUSP2
SCHEMBL8427269 0.74 EGFR (0.43) CYP3A4KDM4EMAPTLMNAALDH1A1
SCHEMBL8307688 0.73 MAPT (0.35) CYP3A4MEN1KMT2AKDM4EMAPT
SCHEMBL8310185 0.72 MAOB (0.41) CYP3A4MEN1KMT2AKDM4EMAPT

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-0709383-B1 Diosmetin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 1999-12-15 EP disclosed
US-5629339-A CHRONIC VENOUS INSUFFICIENCY ADIR ET COMPAGNIE (FR) 1997-05-13 US disclosed
EP-0709383-A1 Diosmetin derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-05-01 EP disclosed