SCHEMBL1646863

SCHEMBL1646863

C=CCc1ccc(-c2ccccc2)c(N)c1CC=C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.36
GABRB2 P47870 2/20 0.36
MAPT P10636 6/20 0.35
GAA P10253 3/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
DPP4 P27487 1/20 0.35
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
POLB P06746 2/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
RXRA P19793 1/20 0.32
NR4A2 P43354 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4D Q08499 1/20 0.32
AURKA O14965 1/20 0.32
DAPK3 O43293 1/20 0.32
MAP4K4 O95819 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
SCHEMBL9786688 0.86 GABRA1 (0.38) GABRA1GABRB2MAPTGAAALDH1A1
SCHEMBL5403133 0.86 GABRA1 (0.40) GABRA1GABRB2MAPTGAAHPGD
SCHEMBL9859732 0.81 GABRA1 (0.37) GABRA1GABRB2MAPTGAAHPGD
SCHEMBL8605193 0.80 GABRA1 (0.36) GABRA1GABRB2MAPTGAAHPGD
SCHEMBL27466255 0.80 GABRA1 (0.36) GABRA1GABRB2MAPTALDH1A1DPP4
SCHEMBL5617569 0.80 GABRA1 (0.36) GABRA1GABRB2MAPTGAAHPGD
SCHEMBL1646927 0.79 GABRA1 (0.50) GABRA1GABRB2MAPTGAAALDH1A1
SCHEMBL2362467 0.77 GABRA1 (0.52) GABRA1GABRB2GAAALDH1A1HPGD
SCHEMBL9504989 0.77 GABRA1 (0.36) GABRA1GABRB2MAPTDPP4MEN1
SCHEMBL10766912 0.76 ALDH1A1 (0.38) GABRA1GABRB2MAPTALDH1A1HPGD

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
EP-2639286-B1 Process for the production of fuel and fuel additives capable for use for internal combustion engines and the fuels and fuel additives obtained MOL MAGYAR OLAJ ES GAZIPARI NYRT (HU) 2023-01-18 EP claimed
EP-2639286-A2 Process for the production of fuel and fuel additives capable for use for internal combustion engines and the fuels and fuel additives obtained MOL Magyar Olaj- és Gázipari Nyrt. (HU) 2013-09-18 EP claimed
EP-2305778-A2 Fuel and fuel additives capable for use for internal combustion engines and process for the production thereof MOL Magyar Olaj- és Gázipari Nyrt. (HU) 2011-04-06 EP claimed
EP-2639286-B1 Process for the production of fuel and fuel additives capable for use for internal combustion engines and the fuels and fuel additives obtained MOL MAGYAR OLAJ ES GAZIPARI NYRT (HU) 2023-01-18 EP disclosed
EP-2305778-B1 Fuel and fuel additives capable for use for internal combustion engines and process for the production thereof MOL MAGYAR OLAJ- ÉS GÁZIPARI NYRT (HU) 2016-12-07 EP disclosed
EP-2639286-A2 Process for the production of fuel and fuel additives capable for use for internal combustion engines and the fuels and fuel additives obtained MOL Magyar Olaj- és Gázipari Nyrt. (HU) 2013-09-18 EP disclosed
EP-2305778-A2 Fuel and fuel additives capable for use for internal combustion engines and process for the production thereof MOL Magyar Olaj- és Gázipari Nyrt. (HU) 2011-04-06 EP disclosed