SCHEMBL8028140

SCHEMBL8028140

O=C(O)C(O)(C1CCCCCC1)C1CCCCO1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
SSTR4 P31391 1/20 0.31

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
SCHEMBL8029828 0.98 KEAP1 (0.37) KEAP1NFE2L2
SCHEMBL66869 0.80 KEAP1 (0.45) KEAP1NFE2L2SSTR4
SCHEMBL8107590 0.76 ALDH1A1 (0.33)
SCHEMBL4888357 0.76 ALDH1A1 (0.32) KEAP1NFE2L2
SCHEMBL15114535 0.73 MEN1 (0.31)
SCHEMBL15114499 0.73 SLC6A3 (0.33)
SCHEMBL8187257 0.70
SCHEMBL29017354 0.67
SCHEMBL29017357 0.67
SCHEMBL7919980 0.67 SMN1; SMN2 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6121241-A TREATING CARDIOVASCULAR DISORDERS GYOGYSZERKUTATO INTEZET KFT. (HU) 2000-09-19 US disclosed
EP-0863871-B1 ANTICOAGULANT PEPTIDE ALDEHYDE DERIVATIVES GYOGYSZERKUTATO INTEZET (HU) 2000-03-08 EP disclosed
EP-0863871-A1 ANTICOAGULANT PEPTIDE ALDEHYDE DERIVATIVES GYOGYSZERKUTATO INTEZET KFT. (HU) 1998-09-16 EP disclosed
WO-1997046523-A1 ANTICOAGULANT PEPTIDE ALDEHYDE DERIVATIVES Gyógyszerkutató Intézet Kft. (HU) 1997-12-11 WO disclosed