SCHEMBL1021604

SCHEMBL1021604

C=CC(OC)c1ccccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
TSHR P16473 3/20 0.42
CA2 P00918 4/20 0.38
CA1 P00915 3/20 0.38
TP53 P04637 2/20 0.38
CA12 O43570 3/20 0.35
CA14 Q9ULX7 3/20 0.35
CA7 P43166 2/20 0.35
CA9 Q16790 2/20 0.35
POLB P06746 2/20 0.35
LMNA P02545 3/20 0.33
ACHE P22303 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
ALOX15 P16050 2/20 0.33
HSD17B10 Q99714 2/20 0.33

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
SCHEMBL5598796 0.86 ESR1 (0.33) GABRA1GABRB2CA2CA1TP53
SCHEMBL460584 0.80 TSHR (0.47) GABRA1GABRB2TSHRCA2CA1
SCHEMBL28899530 0.80 ESR1 (0.34)
SCHEMBL2224883 0.78
SCHEMBL3478188 0.77 GABRA1 (0.38) GABRA1GABRB2TSHRCA2CA1
SCHEMBL11394641 0.74 GABRA1 (0.41) GABRA1GABRB2TSHRCA2CA1
SCHEMBL8752281 0.74 MYC (0.36) TSHRCA2CA1TP53CA9
SCHEMBL10507496 0.74 GABRA1 (0.58) GABRA1GABRB2TSHRCA2CA1
SCHEMBL8761478 0.73 CA1 (0.52) GABRA1GABRB2TSHRCA2CA1
SCHEMBL10504780 0.73 ALDH1A1 (0.50) TSHRKDM4EALDH1A1HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3414269-A1 COMPOSITION OF ORGANIC PEROXIDES AND POLYMER PRE-MIXTURE Arkema France (FR) 2018-12-19 EP claimed
WO-2017137710-A1 COMPOSITION OF ORGANIC PEROXIDES AND POLYMER PRE-MIXTURE ARKEMA FRANCE (FR) 2017-08-17 WO claimed
EP-2550344-B1 PROCESS FOR THE CONVERSION OF LIGNIN TO LIQUID HYDROCARBONS ENI SPA (IT) 2016-05-25 EP claimed
EP-2550344-A2 PROCESS FOR THE CONVERSION OF LIGNIN TO LIQUID HYDROCARBONS ENI S.p.A. (IT) 2013-01-30 EP claimed
WO-2011117705-A2 PROCESS FOR THE CONVERSION OF LIGNIN TO LIQUID HYDROCARBONS ENI S.P.A. (IT) 2011-09-29 WO claimed
EP-3414269-A1 COMPOSITION OF ORGANIC PEROXIDES AND POLYMER PRE-MIXTURE Arkema France (FR) 2018-12-19 EP disclosed
WO-2017137710-A1 COMPOSITION OF ORGANIC PEROXIDES AND POLYMER PRE-MIXTURE ARKEMA FRANCE (FR) 2017-08-17 WO disclosed
EP-2550344-B1 PROCESS FOR THE CONVERSION OF LIGNIN TO LIQUID HYDROCARBONS ENI SPA (IT) 2016-05-25 EP disclosed
US-9334450-B2 Process for the conversion of lignin to liquid hydrocarbons ENI S.P.A. (IT) 2016-05-10 US disclosed
CN-105265397-A Application of eugenol as medicine for preventing bee mites JINHUA ACADEMY OF AGRICULTURAL SCIENCES 2016-01-27 CN disclosed
US-20130060071-A1 PROCESS FOR THE CONVERSION OF LIGNIN TO LIQUID HYDROCARBONS ENI S.P.A. (IT) 2013-03-07 US disclosed
EP-2550344-A2 PROCESS FOR THE CONVERSION OF LIGNIN TO LIQUID HYDROCARBONS ENI S.p.A. (IT) 2013-01-30 EP disclosed
WO-2011117705-A2 PROCESS FOR THE CONVERSION OF LIGNIN TO LIQUID HYDROCARBONS ENI S.P.A. (IT) 2011-09-29 WO disclosed
EP-2271328-A1 ANTISEPTIC COMPOSITIONS FOR THE TREATMENT OF INFECTIONS Alda Pharmaceuticals Corp. (CA) 2011-01-12 EP disclosed
WO-2009114924-A1 ANTISEPTIC COMPOSITIONS FOR THE TREATMENT OF INFECTIONS ALDA PHARMACEUTICALS CORP. (CA) 2009-09-24 WO disclosed
EP-2002721-A2 Tea seed residues and natural tea saponin products Denka International Holding B.V. (NL) 2008-12-17 EP disclosed