SCHEMBL8964677

SCHEMBL8964677

C=Cc1c(N=C=O)cccc1N=C=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.54
GABRA1 P14867 1/20 0.41
GABRB2 P47870 1/20 0.41
TRPA1 O75762 1/20 0.34
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
ABCB11 O95342 1/20 0.31
NR3C1 P04150 1/20 0.31
CYP1A2 P05177 1/20 0.31
ADRA2A P08913 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ALOX15 P16050 1/20 0.31
ADRA2C P18825 1/20 0.31
MAOA P21397 1/20 0.31
DRD1 P21728 1/20 0.31
SLC6A4 P31645 1/20 0.31
HTR2B P41595 1/20 0.31
CCR2 P41597 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL19891826 0.88 CYP3A4 (0.47) CYP3A4GABRA1GABRB2TRPA1ALDH1A1
SCHEMBL19891828 0.87 CYP3A4 (0.55) CYP3A4GABRA1GABRB2TRPA1ALDH1A1
SCHEMBL465790 0.77 CYP3A4 (0.47) CYP3A4GABRA1GABRB2TRPA1ALDH1A1
SCHEMBL7762531 0.77 CYP3A4 (0.47) CYP3A4GABRA1GABRB2TRPA1ALDH1A1
SCHEMBL9585196 0.76 CYP3A4 (0.47) CYP3A4GABRA1GABRB2TRPA1ALDH1A1
SCHEMBL11551480 0.75 TSHR (0.49) CYP3A4ALDH1A1HPGDCYP1A2ALOX15
SCHEMBL9918938 0.75 CYP3A4 (0.66) CYP3A4GABRA1GABRB2TRPA1ALDH1A1
SCHEMBL29085969 0.75 CYP3A4 (0.60) CYP3A4GABRA1GABRB2TRPA1ALDH1A1
SCHEMBL224067 0.75 CYP3A4 (0.60) CYP3A4GABRA1GABRB2TRPA1ALDH1A1
SCHEMBL8676405 0.74 CYP3A4 (0.48) CYP3A4GABRA1GABRB2TRPA1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0454326-B1 Dispersant-antioxidant multifunctional viscosity index improver TEXACO DEVELOPMENT CORP (US) 1996-02-28 EP claimed
EP-0454326-A1 Dispersant-antioxidant multifunctional viscosity index improver TEXACO DEVELOPMENT CORPORATION (US) 1991-10-30 EP claimed
US-5021177-A Lubricating oil containing graft polymer with ethylene backbone TEXACO INC. (US) 1991-06-04 US claimed
EP-0343289-A1 Hydrocarbon compositions containing polyolefin graft polymers TEXACO DEVELOPMENT CORPORATION (US) 1989-11-29 EP claimed
US-4764304-A Hydrocarbon compositions containing polyolefin graft polymers TEXACO INC. (US) 1988-08-16 US claimed
EP-0454326-B1 Dispersant-antioxidant multifunctional viscosity index improver TEXACO DEVELOPMENT CORP (US) 1996-02-28 EP disclosed
US-5021177-A Lubricating oil containing graft polymer with ethylene backbone TEXACO INC. (US) 1991-06-04 US disclosed
EP-0343289-A1 Hydrocarbon compositions containing polyolefin graft polymers TEXACO DEVELOPMENT CORPORATION (US) 1989-11-29 EP disclosed