SCHEMBL4584382

SCHEMBL4584382

O=C1CCC=CCCCCCCCCCCC1.O=C1CCC=CCCCCCCCCCCCC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.58
TRIM33 Q9UPN9 2/20 0.58
ALDH1A1 P00352 2/20 0.58
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC10 Q969S8 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
HDAC9 Q9UKV0 1/20 0.33
HDAC5 Q9UQL6 1/20 0.33
CXCR3 P49682 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
SCHEMBL4326616 1.00 TRIM24 (0.58) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL4320869 1.00 TRIM24 (0.58) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL2196275 1.00 TRIM24 (0.58) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL4326621 1.00 TRIM24 (0.58) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL2196280 1.00 TRIM24 (0.58) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL4326629 1.00 TRIM24 (0.58) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL236422 1.00 TRIM24 (0.58) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL4326613 1.00 TRIM24 (0.58) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL4584380 1.00 TRIM24 (0.58) TRIM24TRIM33ALDH1A1HDAC3HDAC4
SCHEMBL4320871 1.00 TRIM24 (0.58) TRIM24TRIM33ALDH1A1HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1972632-A1 Oxabicycloalkanones as fragrances Symrise GmbH & Co. KG (DE) 2008-09-24 EP disclosed