SCHEMBL3285669

SCHEMBL3285669

C=C(CCC)C(=O)NNCC

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
HDAC3 O15379 4/20 0.34
HDAC1 Q13547 4/20 0.34
HDAC2 Q92769 4/20 0.34
HDAC8 Q9BY41 4/20 0.34
HDAC6 Q9UBN7 1/20 0.34
FFAR3 O14843 3/20 0.33
CTSD P07339 1/20 0.33
TSHR P16473 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL3279306 0.88 CES1 (0.39) CES2CES1TSHRALDH1A1
SCHEMBL3279648 0.85 HDAC3 (0.37) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL1880926 0.82 HDAC3 (0.31) HDAC3HDAC8
SCHEMBL3279719 0.82 HDAC3 (0.41) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL3280451 0.80 CASP2 (0.44) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL3280217 0.80 KDM4E (0.37) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL3279737 0.79 CASP2 (0.47) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL20379712 0.77 FAAH (0.40) CES2CES1HDAC3HDAC1HDAC2
SCHEMBL19639641 0.75 HDAC3 (0.33) HDAC3HDAC1HDAC8HDAC6FFAR3
SCHEMBL8089105 0.75

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
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
CN-1601380-A Dry film photoresist ETERNAL TECHNOLOGY CORP (US) 2005-03-30 CN disclosed
CN-1536444-A Functional polymer ϣ 2004-10-13 CN disclosed