SCHEMBL7057559

SCHEMBL7057559

[CH2]c1cc(CC=C)c(OCC=C)c(CC=C)c1CC=C

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.33
POLB P06746 2/20 0.32
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
CA12 O43570 2/20 0.30
CA1 P00915 2/20 0.30
CA9 Q16790 2/20 0.30
TLR4 O00206 1/20 0.30

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
SCHEMBL790696 0.81 GABRA1 (0.41) POLBMGAMGAASIMGAM2
SCHEMBL20226271 0.79 CA12 (0.33) HSD17B10POLBCYP3A4ALOX15GABRA1
SCHEMBL11639066 0.75 KDM4E (0.37) HSD17B10POLBGAATLR4
SCHEMBL20226270 0.75 GABRA1 (0.44) HSD17B10POLBMGAMGAASI
SCHEMBL28719947 0.74 TLR4 (0.33) TLR4
SCHEMBL1396137 0.73 PTPN1 (0.31)
SCHEMBL9253029 0.73 ALDH1A1 (0.36) POLBGAACYP3A4ALOX15GABRA1
SCHEMBL11602955 0.69 GABRA1 (0.47) GABRA1GABRB2TLR4
SCHEMBL21840790 0.68 TLR4 (0.36) HSD17B10CYP3A4GABRA1GABRB2CA12
SCHEMBL20226269 0.68 HTT (0.36) HSD17B10MGAMGAASIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1397427-A1 THERMOPLASTIC RESINS IN CONTACT WITH METALS OR METAL SALTS STABILIZED BY BLENDS OF DITHIOCARBAMATES AND METAL DEACTIVATORS Crompton Corporation (US) 2004-03-17 EP disclosed
WO-2002092685-A1 THERMOPLASTIC RESINS IN CONTACT WITH METALS OR METAL SALTS STABILIZED BY BLENDS OF DITHIOCARBAMATES AND METAL DEACTIVATORS CROMPTON CORPORATION (US) 2002-11-21 WO disclosed