SCHEMBL3278419

SCHEMBL3278419

CCCCN(C=CC(=O)O)CCCC

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 5/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.40
ACHE P22303 1/20 0.39
BACE1 P56817 1/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA9 Q16790 2/20 0.39
ALDH1A1 P00352 1/20 0.37
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP8 P22894 1/20 0.36
PTPN1 P18031 1/20 0.36
PLA2G1B P04054 2/20 0.35
ATG4B Q9Y4P1 2/20 0.35
AKR1B1 P15121 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL3281988 0.92 ZDHHC20 (0.49) HCAR2ZDHHC20ALDH1A1PTPN1
SCHEMBL3281967 0.92 ZDHHC20 (0.49) HCAR2ZDHHC20ALDH1A1PTPN1
SCHEMBL3279210 0.92 ZDHHC20 (0.49) HCAR2ZDHHC20ALDH1A1PTPN1
SCHEMBL3278091 0.86 HCAR2 (0.39) HCAR2ZDHHC20ACHEBACE1CA12
SCHEMBL28831593 0.86 HCAR2 (0.39) HCAR2ZDHHC20ACHEBACE1CA12
Fumaric Acid SCHEMBL5158743 0.77 ALDH1A1 (0.52) HCAR2ZDHHC20ACHEBACE1CA12
Maleic Acid SCHEMBL5874774 0.77 ALDH1A1 (0.52) HCAR2ZDHHC20ACHEBACE1CA12
Fumaric Acid SCHEMBL5157986 0.77 ALDH1A1 (0.52) HCAR2ZDHHC20ACHEBACE1CA12
Maleic Acid SCHEMBL5874769 0.77 ALDH1A1 (0.52) HCAR2ZDHHC20ACHEBACE1CA12
Fumaric Acid SCHEMBL5158735 0.77 ALDH1A1 (0.52) HCAR2ZDHHC20ACHEBACE1CA12

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-20070113353-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY 2007-05-24 US claimed
US-20100160487-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY (US) 2010-06-24 US disclosed
US-7699941-B2 Polymeric surface treatment compositions THE CLOROX COMPANY (US) 2010-04-20 US disclosed
US-20070113353-A1 Polymeric Surface Treatment Compositions THE CLOROX COMPANY 2007-05-24 US disclosed