SCHEMBL3282859

SCHEMBL3282859

CC=C(C)C(=O)NNCCCC

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 19/20 0.45
HDAC1 Q13547 16/20 0.45
HDAC2 Q92769 16/20 0.45
HDAC8 Q9BY41 5/20 0.45
HDAC6 Q9UBN7 2/20 0.45
NCOR2 Q9Y618 2/20 0.45
HDAC10 Q969S8 1/20 0.45
HDAC11 Q96DB2 1/20 0.45

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
SCHEMBL3279643 0.94 HDAC1 (0.46) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL18950163 0.92 HDAC1 (0.47) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL3280158 0.92 HDAC1 (0.47) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL3286156 0.88 HDAC3 (0.42) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL3278870 0.85 HDAC3 (0.42) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL3280468 0.83 HDAC3 (0.41) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL3282443 0.83 HDAC3 (0.41) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL18950080 0.80 HDAC1 (0.44) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL3280672 0.79 HDAC1 (0.44) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL20849927 0.79 EPHX1 (0.48)

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-7700540-B2 Hard surface cleaning composition THE CLOROX COMPANY (US) 2010-04-20 US claimed
US-20070099816-A1 Hard Surface Cleaning Composition THE CLOROX COMPANY 2007-05-03 US claimed
US-7700540-B2 Hard surface cleaning composition THE CLOROX COMPANY (US) 2010-04-20 US disclosed
US-20070099816-A1 Hard Surface Cleaning Composition THE CLOROX COMPANY 2007-05-03 US disclosed