SCHEMBL819084

SCHEMBL819084

CCOC(C1CCCCC1)C(C(=O)Cl)C1CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
NPSR1 Q6W5P4 2/20 0.35
SHBG P04278 1/20 0.35
TSHR P16473 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
THRB P10828 1/20 0.34
ATM Q13315 1/20 0.34
EPHX1 P07099 3/20 0.33
CYP3A4 P08684 2/20 0.33
CHRM2 P08172 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33
CHRM1 P11229 1/20 0.33
DRD1 P21728 1/20 0.33
SLC6A2 P23975 1/20 0.33
ADRA1A P35348 1/20 0.33
OPRM1 P35372 1/20 0.33
DRD3 P35462 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KCNH2 Q12809 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
SCHEMBL819473 0.98 ALDH1A1 (0.33) ALDH1A1NPSR1SHBGTSHRL3MBTL1
SCHEMBL888585 0.85 ALDH1A1 (0.47) ALDH1A1NPSR1SHBGTSHRL3MBTL1
SCHEMBL888367 0.83 ALDH1A1 (0.44) ALDH1A1NPSR1TSHRL3MBTL1THRB
SCHEMBL888466 0.78 MMP1 (0.34) ALDH1A1NPSR1SHBGTSHRL3MBTL1
SCHEMBL888353 0.76 MMP1 (0.34) ALDH1A1NPSR1TSHREPHX1MMP1
SCHEMBL9134715 0.74 SHBG (0.40) ALDH1A1NPSR1SHBGEPHX1CYP3A4
SCHEMBL1785494 0.72 ALDH1A1 (0.54) ALDH1A1NPSR1SHBGTSHRL3MBTL1
SCHEMBL660922 0.72 ALDH1A1 (0.54) ALDH1A1NPSR1SHBGTSHRL3MBTL1
SCHEMBL1712211 0.70 ALDH1A1 (0.56) ALDH1A1NPSR1TSHRL3MBTL1THRB
SCHEMBL893144 0.70 ALDH1A1 (0.51) ALDH1A1NPSR1SHBGTSHRL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288488-B2 Process for producing solid catalyst component for olefin polymerization SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-16 US disclosed
US-20110269929-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed
US-20110269928-A1 PROCESS FOR PRODUCING SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-03 US disclosed