SCHEMBL4790673

SCHEMBL4790673

C=CCc1ccc(C)c(C)c1.C=CCc1cccc(C)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.42
MAPT P10636 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 4/20 0.39
PPARG P37231 2/20 0.39
PPARD Q03181 2/20 0.39
PPARA Q07869 1/20 0.39
XDH P47989 1/20 0.39
CYP3A4 P08684 3/20 0.38
CYP1A2 P05177 1/20 0.38
GABRA1 P14867 8/20 0.38
GABRB2 P47870 8/20 0.38
CNR2 P34972 5/20 0.38
ALOX5 P09917 5/20 0.38
MEN1 O00255 2/20 0.38
CNR1 P21554 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH2 P05091 1/20 0.38
AKR1B1 P15121 1/20 0.38

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
SCHEMBL1733365 0.85 GABRA1 (0.48) GAAMAPTALDH1A1GABRA1GABRB2
SCHEMBL170383 0.85 GABRA1 (0.48) GAAMAPTALDH1A1GABRA1GABRB2
Hydrochloric Acid SCHEMBL28962287 0.83 GABRA1 (0.47) GAAMAPTALDH1A1GABRA1GABRB2
SCHEMBL2028628 0.83 GABRA1 (0.47) GAAMAPTALDH1A1GABRA1GABRB2
Hydrogen Sulfide SCHEMBL28231532 0.83 GABRA1 (0.47) GAAMAPTALDH1A1GABRA1GABRB2
Ammonia Solution, Strong SCHEMBL8756176 0.83 GABRA1 (0.47) GAAMAPTALDH1A1GABRA1GABRB2
SCHEMBL1734236 0.83 XDH (0.52) GAAMAPTTDP1ALDH1A1PPARG
SCHEMBL1733361 0.83 XDH (0.52) GAAMAPTTDP1ALDH1A1PPARG
Hydrochloric Acid SCHEMBL11352010 0.81 GABRA1 (0.46) GAAMAPTALDH1A1GABRA1GABRB2
Methylamine SCHEMBL28456206 0.80 GABRA1 (0.44) GAAMAPTGABRA1GABRB2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1989313-B Alkylxylene sulfonates for enhanced oil recovery processes CHEVRON ORONITE CO 2011-06-15 CN disclosed
CN-100569889-C Under-neutralized alkylxylene sulfonic acid compositions for enhanced oil recovery processes CHEVRON ORONITE CO (US) 2009-12-16 CN disclosed
EP-1778813-A4 UNDER-NEUTRALIZED ALKYLXYLENE SULFONIC ACID COMPOSITION FOR ENHANCED OIL RECOVERY PROCESSES CHEVRON ORONITE CO (US) 2008-12-17 EP disclosed
EP-1781899-A4 ALKYLXYLENE SULFONATES FOR ENHANCED OIL RECOVERY PROCESSES CHEVRON ORONITE CO (US) 2008-03-19 EP disclosed
CN-1989313-A Alkylxylene sulfonates for enhanced oil recovery processes CHEVRON ORONITE CO (US) 2007-06-27 CN disclosed
CN-1989218-A Under-neutralized alkylxylene sulfonic acid composition for enhanced oil recovery processes CHEVRON ORONITE CO (US) 2007-06-27 CN disclosed
EP-1781899-A2 ALKYLXYLENE SULFONATES FOR ENHANCED OIL RECOVERY PROCESSES Chevron Oronite Company LLC (US) 2007-05-09 EP disclosed
EP-1778813-A2 UNDER-NEUTRALIZED ALKYLXYLENE SULFONIC ACID COMPOSITION FOR ENHANCED OIL RECOVERY PROCESSES Chevron Oronite Company LLC (US) 2007-05-02 EP disclosed
WO-2005018300-A2 ALKYLXYLENE SULFONATES FOR ENHANCED OIL RECOVERY PROCESSES CHEVRON ORONITE COMPANY LLC (US) 2005-03-03 WO disclosed
WO-2004101473-A2 UNDER-NEUTRALIZED ALKYLXYLENE SULFONIC ACID COMPOSITION FOR ENHANCED OIL RECOVERY PROCESSES CHEVRON ORONITE COMPANY LLC (US) 2004-11-25 WO disclosed