SCHEMBL1746341

SCHEMBL1746341

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA2 P00918 1/20 0.40
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
MMP9 P14780 1/20 0.35
MMP13 P45452 1/20 0.35
CYP2C19 P33261 2/20 0.33
CYP2D6 P10635 1/20 0.33
CACNA2D1 P54289 2/20 0.32
GRIK1 P39086 2/20 0.32
CACNB3 P54284 1/20 0.32
CACNA1C Q13936 1/20 0.32
PGR P06401 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
CACNA2D2 Q9NY47 1/20 0.32
RNPEP Q9H4A4 1/20 0.32
SLC7A5 Q01650 1/20 0.32

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
SCHEMBL11800170 0.88 ALDH1A1 (0.44) ALDH1A1TDP1CA2MMP1MMP2
SCHEMBL8669803 0.82 TDP1 (0.36) ALDH1A1TDP1GRIK1
SCHEMBL11151369 0.81 FNTA (0.44) ALDH1A1TDP1
SCHEMBL11151364 0.81 FNTA (0.44) ALDH1A1TDP1
SCHEMBL1017646 0.79 ALDH1A1 (0.50) ALDH1A1TDP1CA2MMP1MMP2
SCHEMBL670991 0.79 ALDH1A1 (0.50) ALDH1A1TDP1CA2MMP1MMP2
SCHEMBL18640438 0.79 ALDH1A1 (0.50) ALDH1A1TDP1CA2MMP1MMP2
SCHEMBL670992 0.79 ALDH1A1 (0.50) ALDH1A1TDP1CA2MMP1MMP2
SCHEMBL1017645 0.79 ALDH1A1 (0.50) ALDH1A1TDP1CA2MMP1MMP2
SCHEMBL4650532 0.78 FNTA (0.55) ALDH1A1TDP1

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2889938-B1 BINDER HAVING EXCELLENT ADHESIVENESS FOR SECONDARY BATTERIES LG CHEMICAL LTD (KR) 2018-01-10 EP claimed
EP-0507409-B1 Printing film ARKWRIGHT INC (US) 1996-09-25 EP claimed
EP-0175562-B1 VINYL CAPROLACTAM CONTAINING HOT MELT ADHESIVES JOHNSON & JOHNSON MEDICAL, INC. (US) 1992-04-29 EP claimed
EP-2168633-B1 Cosmetic composition comprising organic derivatives of silicium containing at least a basic moiety as pre-treatment before a composition comprising a film-forming hydrophobic polymer, a pigment and a solvent ORÉAL L (FR) 2016-03-30 EP disclosed
EP-2384737-B1 COSMETIC COMPOSITION COMPRISING A SPECIFIC SILICONE COPOLYMER AND AT LEAST TWO LIQUID LINEAR VOLATILE ALKANES OREAL (FR) 2013-10-02 EP disclosed
EP-2070516-B1 Process for dyeing the hair using a composition comprising a hydrophobic film-forming polymer, a pigment and a volatile solvent OREAL (FR) 2013-08-14 EP disclosed
EP-2384737-A2 COSMETIC COMPOSITION COMPRISING A SPECIFIC SILICONE COPOLYMER AND AT LEAST ONE LIQUID LINEAR VOLATILE ALKANE L'Oréal (FR) 2011-11-09 EP disclosed
EP-2263647-A1 Composition for treating keratin fibres, comprising a polyalkene-based supramolecular polymer, a block polymer and a volatile solvent L'Oréal (FR) 2010-12-22 EP disclosed
EP-2189148-A2 Dye composition for keratin fibres comprising a supramolecular polymer based on polyalcene, a pigment and a volatile solvent L'OREAL (FR) 2010-05-26 EP disclosed
EP-2168633-A2 Use of a cosmetic composition comprising organic derivatives of silicium containing at least a basic moiety as pre-treatment before a composition comprising a film-forming hydrophobic polymer, a pigment and a solvent L'OREAL (FR) 2010-03-31 EP disclosed
EP-2070516-A1 Process for dyeing the hair using a composition comprising a hydrophobic film-forming polymer, a pigment and a volatile solvent L'Oréal (FR) 2009-06-17 EP disclosed
WO-2006086444-A1 COMPOSITION AND SYSTEM FOR HAIR COLORING AND COLOR RETENTION FAROUK SYSTEMS, INC. (US) 2006-08-17 WO disclosed