SCHEMBL8901391

SCHEMBL8901391

O=C(O)Oc1ccc(/C=C\c2ccc(OC(=O)O)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.60
KDM4E B2RXH2 1/20 0.60
MEN1 O00255 1/20 0.60
LMNA P02545 1/20 0.60
TTR P02766 1/20 0.60
TP53 P04637 1/20 0.60
CYP3A4 P08684 1/20 0.60
MAPT P10636 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
RAD51 Q06609 1/20 0.52
TUBB4A P04350 2/20 0.50
TUBB P07437 2/20 0.50
TUBA3C P0DPH7 2/20 0.50
TUBA1B P68363 2/20 0.50
TUBA4A P68366 2/20 0.50
TUBB4B P68371 2/20 0.50
TUBB3 Q13509 2/20 0.50
TUBB2A Q13885 2/20 0.50
TUBB8 Q3ZCM7 2/20 0.50
TUBA3E Q6PEY2 2/20 0.50

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
SCHEMBL2465289 1.00 KMT2A (0.60) KMT2AKDM4EMEN1LMNATTR
SCHEMBL475747 1.00 KMT2A (0.60) KMT2AKDM4EMEN1LMNATTR
SCHEMBL9248649 0.94 KMT2A (0.61) KMT2AKDM4EMEN1LMNATTR
SCHEMBL10439489 0.90 KMT2A (0.51) KMT2AKDM4EMEN1LMNATTR
SCHEMBL21110881 0.87 CYP3A4 (0.55) KMT2AKDM4EMEN1LMNATTR
SCHEMBL8900000 0.85 KMT2A (0.56) KMT2AKDM4EMEN1LMNATTR
SCHEMBL8901405 0.85 KMT2A (0.56) KMT2AKDM4EMEN1LMNATTR
SCHEMBL465132 0.84 LMNA (0.52) KMT2AMEN1LMNAMAPTSMN1; SMN2
SCHEMBL10941162 0.84 MAPT (0.81) KMT2AKDM4EMEN1LMNATTR
SCHEMBL11354408 0.84 MAPT (0.81) KMT2AKDM4EMEN1LMNATTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0663391-B1 Sulphuric acid esters of sugar alcohols for the treatment of arteriosclerotic changes in the vascular walls HOFFMANN LA ROCHE (CH) 1997-04-09 EP disclosed
EP-0741139-A1 Sulphuric acid esters of amino sugars F. HOFFMANN-LA ROCHE AG (CH) 1996-11-06 EP disclosed
EP-0663391-A1 Sulphuric acid esters of sugar alcohols for the treatment of arteriosclerotic changes in the vascular walls F. HOFFMANN-LA ROCHE AG (CH) 1995-07-19 EP disclosed
EP-0391212-B1 Process for preparing bifunctional Z-stilbene compounds, new bifunctional Z-stilbene compounds and their use for preparing polymers BAYER AG (DE) 1994-05-25 EP disclosed
EP-0391212-A2 Process for preparing bifunctional Z-stilbene compounds, new bifunctional Z-stilbene compounds and their use for preparing polymers BAYER AG (DE) 1990-10-10 EP disclosed
EP-0391204-A2 Process for preparing moulded articles of polymers with E-configurated stilbene moieties BAYER AG (DE) 1990-10-10 EP disclosed