SCHEMBL4914532

SCHEMBL4914532

C=C(CC)C(=O)OCCCCCC.CC=Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.46
ALDH1A1 P00352 2/20 0.46
LMNA P02545 2/20 0.46
KDM4E B2RXH2 2/20 0.46
TDP1 Q9NUW8 1/20 0.44
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPK1 P28482 1/20 0.43
EGFR P00533 1/20 0.43
POLB P06746 2/20 0.41
HSD17B10 Q99714 1/20 0.41
PPARG P37231 3/20 0.41
APP P05067 3/20 0.40
BCHE P06276 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ACHE P22303 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
Styrene SCHEMBL491216 0.87 TSHR (0.48) TSHRALDH1A1LMNAKDM4ETDP1
SCHEMBL7717061 0.87 KDM4E (0.46) TSHRALDH1A1LMNAKDM4ETDP1
SCHEMBL11065389 0.86 KDM4E (0.47) TSHRALDH1A1LMNAKDM4ETDP1
SCHEMBL11326445 0.86 EGFR (0.45) TSHRALDH1A1LMNAKDM4ETDP1
SCHEMBL6765656 0.86 KDM4E (0.43) TSHRALDH1A1LMNAKDM4ETDP1
Styrene SCHEMBL10533310 0.84 TSHR (0.45) TSHRALDH1A1LMNAKDM4ETDP1
SCHEMBL3331594 0.84 KDM4E (0.43) TSHRALDH1A1LMNAKDM4ETDP1
Benzene SCHEMBL8820585 0.84 TSHR (0.62) TSHRALDH1A1LMNAKDM4ETP53
SCHEMBL9442161 0.84 TSHR (0.47) TSHRALDH1A1LMNAKDM4ETDP1
SCHEMBL7242327 0.84 TSHR (0.47) TSHRALDH1A1LMNAKDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080008677-A1 COMPOSITIONS COMPRISING AT LEAST ONE ORGANIC POLYMER AND A MIXTURE OF VOLATILE AND NONVOLATILE SOLVENTS L'OREAL 2008-01-10 US claimed
US-20060039881-A2 COMPOSITIONS COMPRISING AT LEAST ONE ORGANIC POLYMER AND A MIXTURE OF VOLATILE AND NONVOLATILE SOLVENTS L'OREAL S.A. (FR) 2006-02-23 US claimed
US-20040234473-A1 Compositions comprising at least one organic polymer and a mixture of volatile and nonvolatile solvents L'OREAL S.A. 2004-11-25 US claimed
EP-1069151-B1 Composition containing an organic polymer and mixed volatile and non volatile solvents OREAL (FR) 2002-12-11 EP claimed
US-20080008677-A1 COMPOSITIONS COMPRISING AT LEAST ONE ORGANIC POLYMER AND A MIXTURE OF VOLATILE AND NONVOLATILE SOLVENTS L'OREAL 2008-01-10 US disclosed
US-20060039881-A2 COMPOSITIONS COMPRISING AT LEAST ONE ORGANIC POLYMER AND A MIXTURE OF VOLATILE AND NONVOLATILE SOLVENTS L'OREAL S.A. (FR) 2006-02-23 US disclosed
US-20040234473-A1 Compositions comprising at least one organic polymer and a mixture of volatile and nonvolatile solvents L'OREAL S.A. 2004-11-25 US disclosed