SCHEMBL3281967

SCHEMBL3281967

CCCCCCCCN(C=CC(=O)O)CCCCCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.49
HCAR2 Q8TDS4 3/20 0.46
PTPN1 P18031 3/20 0.41
GPR84 Q9NQS5 7/20 0.40
PPARG P37231 6/20 0.40
PPARD Q03181 6/20 0.40
PPARA Q07869 6/20 0.40
HDAC11 Q96DB2 5/20 0.40
TSHR P16473 4/20 0.40
ALDH1A1 P00352 2/20 0.40
TLR2 O60603 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
FABP4 P15090 2/20 0.40
SLC22A6 Q4U2R8 1/20 0.40
SLC22A8 Q8TCC7 1/20 0.40
MEN1 O00255 1/20 0.40
ESR1 P03372 1/20 0.40
ALOX15 P16050 1/20 0.40
PDE4A P27815 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL3279210 1.00 ZDHHC20 (0.49) ZDHHC20HCAR2PTPN1GPR84PPARG
SCHEMBL3281988 1.00 ZDHHC20 (0.49) ZDHHC20HCAR2PTPN1GPR84PPARG
SCHEMBL3278419 0.92 HCAR2 (0.42) ZDHHC20HCAR2PTPN1ALDH1A1
SCHEMBL28831593 0.83 HCAR2 (0.39) ZDHHC20HCAR2TSHRALDH1A1
SCHEMBL3278091 0.83 HCAR2 (0.39) ZDHHC20HCAR2TSHRALDH1A1
Fumaric Acid SCHEMBL3414625 0.78 HCAR2 (0.65) HCAR2PTPN1GPR84PPARGPPARD
Decane SCHEMBL9668679 0.78 HCAR2 (0.65) HCAR2PTPN1GPR84PPARGPPARD
Octane SCHEMBL8193217 0.78 HCAR2 (0.65) HCAR2PTPN1GPR84PPARGPPARD
Fumaric Acid SCHEMBL3414623 0.78 HCAR2 (0.65) HCAR2PTPN1GPR84PPARGPPARD
Octane SCHEMBL6872110 0.78 HCAR2 (0.65) HCAR2PTPN1GPR84PPARGPPARD

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