SCHEMBL4382801

SCHEMBL4382801

CCCCCCCCCC=COc1ccccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 3/20 0.44
F3 P13726 3/20 0.44
MMP2 P08253 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
ECE1 P42892 1/20 0.44
SGMS1 Q86VZ5 1/20 0.44
SGMS2 Q8NHU3 1/20 0.44
MUS81 Q96NY9 1/20 0.44
HSD17B10 Q99714 1/20 0.44
SAE1 Q9UBE0 1/20 0.44
HTR1A P08908 3/20 0.42
EPHX2 P34913 2/20 0.42
BID P55957 3/20 0.41
BCL2L1 Q07817 3/20 0.41
MCL1 Q07820 3/20 0.41
BAK1 Q16611 3/20 0.41
TRPV1 Q8NER1 2/20 0.40
SOAT2 O75908 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
SCHEMBL22207137 0.83 SOAT2 (0.38) EPHX2TRPV1SOAT2SOAT1CYP2D6
SCHEMBL22207272 0.83 SOAT2 (0.38) EPHX2TRPV1SOAT2SOAT1CYP2D6
SCHEMBL22207359 0.83 SOAT2 (0.38) EPHX2TRPV1SOAT2SOAT1CYP2D6
SCHEMBL22207084 0.83 SOAT2 (0.38) EPHX2TRPV1SOAT2SOAT1CYP2D6
SCHEMBL22207495 0.83 SOAT2 (0.38) EPHX2TRPV1SOAT2SOAT1CYP2D6
SCHEMBL22207083 0.83 SOAT2 (0.38) EPHX2TRPV1SOAT2SOAT1CYP2D6
SCHEMBL22207138 0.83 SOAT2 (0.38) EPHX2TRPV1SOAT2SOAT1CYP2D6
SCHEMBL22207490 0.83 SOAT2 (0.38) EPHX2TRPV1SOAT2SOAT1CYP2D6
SCHEMBL22207259 0.83 SOAT2 (0.38) EPHX2TRPV1SOAT2SOAT1CYP2D6
SCHEMBL22207260 0.83 SOAT2 (0.38) EPHX2TRPV1SOAT2SOAT1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0583178-B1 Improvement in the preparation of superabsorbant polyacrylates ATOCHEM ELF SA (FR) 1996-12-04 EP claimed
EP-1404762-B1 A METHOD OF COLORING HAIR USING CATIONIC DYES BASF SE (DE) 2009-11-25 EP disclosed
US-7078498-B2 Method of coloring hair using cationic dyes CIBE SPECIALTY CHEMICALS CORPORATION (US) 2006-07-18 US disclosed
US-6949630-B2 Cationic reactive dyes CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-09-27 US disclosed
EP-1404762-A1 A METHOD OF COLORING HAIR USING CATIONIC DYES Ciba SC Holding AG (CH) 2004-04-07 EP disclosed
WO-2003006554-A1 A METHOD OF COLORING HAIR USING CATIONIC DYES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-01-23 WO disclosed
EP-0509924-B1 Method for improving dispersibility and filtrablity of watersoluble polymer powders ELF AQUITAINE (FR) 1996-07-31 EP disclosed
EP-0509924-A1 Method for improving dispersibility and filtrablity of watersoluble polymer powders ELF AQUITAINE (FR) 1992-10-21 EP disclosed
US-4025709-A Process for the polymerization of vinylidene fluoride PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1977-05-24 US disclosed