SCHEMBL6483474

SCHEMBL6483474

O=C(O)CCCOc1ccc2cc3ccccc3cc2c1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN7 P35236 1/20 0.60
CYSLTR2 Q9NS75 4/20 0.58
CYSLTR1 Q9Y271 4/20 0.58
PPARA Q07869 3/20 0.56
HDAC1 Q13547 1/20 0.56
KDM4E B2RXH2 2/20 0.54
ALDH1A1 P00352 1/20 0.54
FFAR4 Q5NUL3 3/20 0.54
FFAR1 O14842 2/20 0.54
CYP1A2 P05177 1/20 0.53
MAPK1 P28482 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
PDK2 Q15119 1/20 0.51
PDE2A O00408 1/20 0.51
PDE3B Q13370 1/20 0.51
PDE3A Q14432 1/20 0.51
P2RY12 Q9H244 1/20 0.51

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
SCHEMBL10618679 0.95 PPARA (0.63) PTPN7CYSLTR2CYSLTR1PPARAHDAC1
SCHEMBL20886118 0.95 PTPN7 (0.67) PTPN7CYSLTR2CYSLTR1PPARAHDAC1
SCHEMBL30539402 0.95 PTPN7 (0.67) PTPN7CYSLTR2CYSLTR1PPARAHDAC1
SCHEMBL10722424 0.90 HDAC1 (0.68) PTPN7CYSLTR2CYSLTR1PPARAHDAC1
SCHEMBL20897621 0.89 PPARA (0.64) PTPN7CYSLTR2CYSLTR1PPARAHDAC1
SCHEMBL10727767 0.89 HDAC1 (0.71) PTPN7CYSLTR2CYSLTR1PPARAHDAC1
SCHEMBL20910939 0.89 HDAC1 (0.71) PTPN7CYSLTR2CYSLTR1PPARAHDAC1
SCHEMBL20886119 0.89 HDAC1 (0.71) PTPN7CYSLTR2CYSLTR1PPARAHDAC1
SCHEMBL31297136 0.89 HDAC1 (0.71) PTPN7CYSLTR2CYSLTR1PPARAHDAC1
SCHEMBL8355645 0.89 HDAC1 (0.71) PTPN7CYSLTR2CYSLTR1PPARAHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003037279-A1 USE OF A POLYMER WITH HYDROPHOBIC GROUPS AS A THICKENING OR GELLING AGENT, A COMPOSITION CONTAINING SAME AND THE ASSOCIATED GELATION METHOD L'OREAL (FR) 2003-05-08 WO claimed
WO-1988000938-A1 THERMALLY REVERSIBLE ORGANIC SOLVENT GELS GEORGETOWN UNIVERSITY (US) 1988-02-11 WO claimed
CN-117712476-A Gel quasi-solid electrolyte and lithium battery prepared from same 湖南大学 2024-03-15 CN disclosed
US-6872243-B2 Phase change inks containing gelator additives XEROX CORPORATION (US) 2005-03-29 US disclosed
US-20040065227-A1 Phase change inks containing gelator additives XEROX CORPORATION 2004-04-08 US disclosed
WO-2003037279-A1 USE OF A POLYMER WITH HYDROPHOBIC GROUPS AS A THICKENING OR GELLING AGENT, A COMPOSITION CONTAINING SAME AND THE ASSOCIATED GELATION METHOD L'OREAL (FR) 2003-05-08 WO disclosed
WO-2002047628-A1 COMPOSITION STRUCTURED WITH A POLYMER CONTAINING A HETEROATOM AND AN ORGANOGELATOR L'ORÉAL (FR) 2002-06-20 WO disclosed
US-4790961-A CHOLESTERYL ESTERS OF ANTHRACENES AS GELLING AGENTS GEORGETOWN UNIVERSITY (US) 1988-12-13 US disclosed
WO-1988000938-A1 THERMALLY REVERSIBLE ORGANIC SOLVENT GELS GEORGETOWN UNIVERSITY (US) 1988-02-11 WO disclosed