SCHEMBL259001

SCHEMBL259001

Cc1ccc(CC(C)C)c(CC(C)C)c1O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.50
GABRB2 P47870 2/20 0.50
ELANE P08246 3/20 0.36
CTSG P08311 1/20 0.36
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ALDH1A1 P00352 1/20 0.34
BCL2 P10415 3/20 0.34
MCL1 Q07820 3/20 0.34
BAD Q92934 1/20 0.34
HTR1D P28221 1/20 0.32
HTR1B P28222 1/20 0.32
TRPA1 O75762 2/20 0.31
PTGS1 P23219 1/20 0.31
CACNA1C Q13936 1/20 0.31
GPR55 Q9Y2T6 1/20 0.31
CFTR P13569 1/20 0.31

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
SCHEMBL29079425 0.85 GABRA1 (0.61) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL23387421 0.84 GABRA1 (0.55) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL8850895 0.83 GABRA1 (0.42) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL31015759 0.82 GABRA1 (0.52) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL29079409 0.82 GABRA1 (0.52) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL29582838 0.79 GABRA1 (0.39) GABRA1GABRB2
SCHEMBL248342 0.78 GABRA1 (0.48) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL6455177 0.78 GABRA1 (0.57) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL259002 0.76 GABRA1 (0.48) GABRA1GABRB2ELANECTSGKDM4E
SCHEMBL5587185 0.75 GABRA1 (0.73) GABRA1GABRB2ELANECTSGKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3825145-A1 TIRE RUBBER COMPOSITION AND TIRE Sumitomo Rubber Industries, Ltd. (JP) 2021-05-26 EP disclosed
US-8524643-B2 Surfactant mixtures for tertiary oil recovery BASF SE (DE) 2013-09-03 US disclosed
US-20120012311-A1 Surfactant Mixtures for Tertiary Oil Recovery BASF SE (DE) 2012-01-19 US disclosed
US-8053396-B2 recovering hydrocarbons from underground deposits by surfactant flooding ( surfactant and cosurfactant), cosurfactant containing amphiphilic polymer having one or more hydrophobic subunits based on a polyisobutene block, have terminally arranged double bonds, and hydrophilic subunits BASF SE (DE) 2011-11-08 US disclosed
US-7727948-B2 Mixture, comprising a surfactant and a cosurfactant that is an amphiphilic polymer BASF SE (DE) 2010-06-01 US disclosed
EP-1893717-B1 SURFACTANT MIXTURES FOR TERTIARY OIL RECOVERY BASF SE (DE) 2010-05-19 EP disclosed
US-20080194435-A1 Surfactant Mixtures For Tertiary Oil Recovery BASF AKTIENGESELLSCHAFT (DE) 2008-08-14 US disclosed
US-20070060495-A1 Mixture, comprising a surfactant and a cosurfactant BASF AKTIENGESELLSCHAFT (DE) 2007-03-15 US disclosed
EP-1631372-A1 MIXTURE COMPRISING A SURFACTANT AND A COSURFACTANT BASF AKTIENGESELLSCHAFT (DE) 2006-03-08 EP disclosed
WO-2004103542-A1 MIXTURE, COMPRISING A SURFACTANT AND A COSURFACTANT BASF AKTIENGESELLSCHAFT (DE) 2004-12-02 WO disclosed
US-5112364-A Improved valve cleaning BASF AKTIENGESELLSCHAFT (DE) 1992-05-12 US disclosed