SCHEMBL8209626

SCHEMBL8209626

C=CC(=O)C1=CC=CC[CH]1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.33
ALDH5A1 P51649 1/20 0.32
ABAT P80404 1/20 0.32

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
SCHEMBL7046884 0.74
SCHEMBL8562622 0.72
SCHEMBL10998680 0.72
SCHEMBL14596688 0.71 AKT1 (0.32) AKT1ALDH5A1ABAT
SCHEMBL3939619 0.70
SCHEMBL8546188 0.68 ALDH1A1 (0.31)
SCHEMBL969859 0.68 TSHR (0.33)
SCHEMBL4629837 0.67
SCHEMBL2792981 0.67 PSMB11 (0.42)
SCHEMBL8607446 0.64 SRD5A2 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0991940-A1 USE OF MONOLITHIC SORBENTS FOR PREPARATIVE CHROMATOGRAPHIC SEPARATION MERCK PATENT GmbH (DE) 2000-04-12 EP disclosed
WO-1998058253-A1 USE OF MONOLITHIC SORBENTS FOR PREPARATIVE CHROMATOGRAPHIC SEPARATION MERCK PATENT GMBH (DE) 1998-12-23 WO disclosed