SCHEMBL3277694

SCHEMBL3277694

CCCCCCCN(CCCCCCC)/C(C)=C(\C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.50
FNTB P49356 2/20 0.50
THRB P10828 1/20 0.50
PGGT1B P53609 1/20 0.50
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA9 Q16790 2/20 0.44
CA2 P00918 1/20 0.44
ZDHHC20 Q5W0Z9 2/20 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
PTPN1 P18031 2/20 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
SCHEMBL3284928 1.00 FNTA (0.50) FNTAFNTBTHRBPGGT1BCA12
SCHEMBL3279297 1.00 FNTA (0.50) FNTAFNTBTHRBPGGT1BCA12
SCHEMBL3282611 0.92 CA12 (0.48) FNTAFNTBTHRBPGGT1BCA12
SCHEMBL3278732 0.83 CA12 (0.44) FNTAFNTBTHRBPGGT1BCA12
SCHEMBL6450984 0.81 FNTA (0.47) FNTAFNTBTHRBPGGT1BCA12
SCHEMBL6450884 0.81 FNTA (0.47) FNTAFNTBTHRBPGGT1BCA12
SCHEMBL7178901 0.81 FNTA (0.47) FNTAFNTBTHRBPGGT1BCA12
SCHEMBL3819591 0.78 FNTA (0.44) FNTAFNTBTHRBPGGT1BCA12
SCHEMBL17226465 0.77 CA12 (0.48) CA12CA1CA9CA2ZDHHC20
SCHEMBL17226472 0.77 CA12 (0.48) CA12CA1CA9CA2ZDHHC20

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