SCHEMBL9768377

SCHEMBL9768377

C=CCOc1cccc(OCC=C)c1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.50
ADRA2B P18089 1/20 0.50
ADRA2C P18825 1/20 0.50
ALDH1A1 P00352 3/20 0.49
MAPK1 P28482 2/20 0.49
HPGD P15428 2/20 0.49
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MAPT P10636 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
TDP1 Q9NUW8 1/20 0.48
CYP3A4 P08684 1/20 0.47
CYP2A6 P11509 1/20 0.47
LIG1 P18858 1/20 0.46
KDM4E B2RXH2 2/20 0.45
SLC22A1 O15245 1/20 0.44
LMNA P02545 1/20 0.44
CYP1A2 P05177 1/20 0.44
ADRB2 P07550 1/20 0.44
ADRB1 P08588 1/20 0.44

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
SCHEMBL1727026 0.90 ALDH1A1 (0.53) ADRA2AADRA2BADRA2CALDH1A1MAPK1
SCHEMBL10158237 0.88 CYP1A2 (0.46) ADRA2AADRA2BADRA2CALDH1A1MAPK1
SCHEMBL11144150 0.87 MRGPRX4 (0.44) ADRA2AADRA2BADRA2CALDH1A1MAPK1
SCHEMBL21728039 0.87 MAPT (0.47) ADRA2AADRA2BADRA2CALDH1A1MAPK1
SCHEMBL5513156 0.87 ADRA2A (0.44) ADRA2AADRA2BADRA2CALDH1A1MAPK1
SCHEMBL4865834 0.87 HPGD (0.46) ADRA2AADRA2BADRA2CALDH1A1MAPK1
SCHEMBL5806322 0.86 HPGD (0.51) ADRA2AADRA2BADRA2CALDH1A1MAPK1
SCHEMBL12533543 0.86 MAPT (0.74) ALDH1A1MAPK1HPGDTSHRHSD17B10
SCHEMBL5244168 0.84 ALDH1A1 (0.48) ADRA2AADRA2BADRA2CALDH1A1MAPK1
1,2-Diallyloxybenzene SCHEMBL29768784 0.81 HPGD (0.60) ADRA2AADRA2BADRA2CALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0253600-B1 BISMALEIMIDE FORMULATIONS CONTAINING OLEFINIC ETHER MODIFIERS AMOCO CORPORATION (US) 1991-12-18 EP claimed
US-4853449-A PREPREG RESINS FOR TAPE OR TOW FABRICATION AMOCO CORPORATION (US) 1989-08-01 US claimed
EP-0253600-A2 Bismaleimide formulations containing olefinic ether modifiers AMOCO CORPORATION (US) 1988-01-20 EP claimed
EP-0253600-B1 BISMALEIMIDE FORMULATIONS CONTAINING OLEFINIC ETHER MODIFIERS AMOCO CORPORATION (US) 1991-12-18 EP disclosed
US-4853449-A PREPREG RESINS FOR TAPE OR TOW FABRICATION AMOCO CORPORATION (US) 1989-08-01 US disclosed
EP-0253600-A2 Bismaleimide formulations containing olefinic ether modifiers AMOCO CORPORATION (US) 1988-01-20 EP disclosed