SCHEMBL248039

SCHEMBL248039

CC(C)Cc1cccc(OC(=O)Oc2cccc(CC(C)C)c2CC(C)C)c1CC(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
ELANE P08246 1/20 0.38
HPGD P15428 2/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
ALOX15 P16050 1/20 0.33
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
GSK3B P49841 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
PLA2G2F Q9BZM2 1/20 0.33
PTGER1 P34995 1/20 0.33
PTGER4 P35408 1/20 0.33
PTGER3 P43115 1/20 0.33
PTGER2 P43116 1/20 0.33
CTSS P25774 1/20 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
SCHEMBL248040 0.89 GABRA1 (0.46) GABRA1GABRB2ELANEHPGDHTT
SCHEMBL19181573 0.84 GABRA1 (0.47) GABRA1GABRB2HPGDHTTKDM4E
SCHEMBL29416762 0.84 GABRA1 (0.47) GABRA1GABRB2HPGDHTTKDM4E
SCHEMBL5685706 0.81 GABRA1 (0.52) GABRA1GABRB2ELANEHPGDHTT
SCHEMBL1156947 0.79 CTSS (0.43) GABRA1GABRB2ELANEHPGDHTT
SCHEMBL248141 0.78 POLB (0.43) GABRA1GABRB2ELANEHPGDHTT
SCHEMBL28422031 0.78 INPPL1 (0.47) GABRA1GABRB2ELANEHPGDKDM4E
SCHEMBL11452874 0.77 GABRA1 (0.47) GABRA1GABRB2ELANEHPGDHTT
SCHEMBL20213778 0.76 GABRA1 (0.46) GABRA1GABRB2ELANECTSSCTSK
SCHEMBL2743774 0.75 GABRA1 (0.62) GABRA1GABRB2ELANEHSD17B10

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 53 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6734278-B2 MELT ESTER INTERCHANGE BAYER AKTIENGESELLSCHAFT (DE) 2004-05-11 US claimed
US-20030139564-A1 Production of polyester carbonates BAYER AKTIENGESELLSCHAFT (DE) 2003-07-24 US claimed
US-10272654-B2 Polycarbonate composition having improved flame resistance for extrusion applications COVESTRO DEUTSCHLAND AG (DE) 2019-04-30 US disclosed
US-9676716-B2 Polycarbonate having improved thermal and mechanical properties and reduced coefficients of thermal expansion COVESTRO DEUTSCHLAND AG (DE) 2017-06-13 US disclosed
US-8969477-B2 Polycarbonate compositions having improved mechanical properties BAYER MATERIALSCIENCE AG (DE) 2015-03-03 US disclosed
US-8507635-B2 Modified polycarbonates having improved surface properties BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-08-13 US disclosed
US-8470934-B2 Polycarbonate compositions having improved surface hardness BAYER MATERIALSCIENCE AG (DE) 2013-06-25 US disclosed
US-8329852-B2 Copolycarbonates having improved surface hardness BAYER MATERIALSCIENCE AG (DE) 2012-12-11 US disclosed
US-20120259055-A1 POLYCARBONATE COMPOSITIONS HAVING IMPROVED MECHANICAL PROPERTIES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-10-11 US disclosed
US-20120244359-A1 POLYCARBONATE COMPOSITION HAVING IMPROVED FLAME RESISTANCE FOR EXTRUSION APPLICATIONS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-09-27 US disclosed
US-20120231278-A1 POLYCARBONATE COMPOSITION HAVING IMPROVED FLAME RESISTANCE FOR EXTRUSION APPLICATIONS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-09-13 US disclosed
US-6734278-B2 MELT ESTER INTERCHANGE BAYER AKTIENGESELLSCHAFT (DE) 2004-05-11 US disclosed
US-20040030090-A1 Polycarbonates, polyester carbonates and polyesters with special branched terminal groups BAYER AKTIENGESELLSCHAFT (DE) 2004-02-12 US disclosed
US-6646099-B2 Production and use of polyester carbonates BAYER AKTIENGESELLSCHAFT (DE) 2003-11-11 US disclosed
US-20030204042-A1 Production and use of high molecular weight aliphatic polycarbonates BAYER AKTIENGESELLSCHAFT (DE) 2003-10-30 US disclosed
US-20030139564-A1 Production of polyester carbonates BAYER AKTIENGESELLSCHAFT (DE) 2003-07-24 US disclosed
US-20030105272-A1 Production and use of polyester carbonates BAYER AKTIENGESELLSCHAFT (DE) 2003-06-05 US disclosed
US-20030055201-A1 Process for optimising the production of polycarbonate by melt transesterification BAYER AKTIENGESELLSCHAFT (DE) 2003-03-20 US disclosed
US-20030027971-A1 Preparation of copolycarbonates BAYER AKTIENGESELLSCHAFT (DE) 2003-02-06 US disclosed
US-20020177684-A1 Process for producing polycarbonates BAYER AKTIENGESELLSCHAFT (DE) 2002-11-28 US disclosed