SCHEMBL6062973

SCHEMBL6062973

CCCOC(=O)C(C(=O)OCCC)C1CCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.42
ALDH1A1 P00352 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
THRB P10828 1/20 0.39
PPM1B O75688 1/20 0.38
PTPN1 P18031 1/20 0.38
PPP1CC P36873 1/20 0.38
KDM4E B2RXH2 1/20 0.36
CHRM2 P08172 1/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
CHRM1 P11229 1/20 0.35
DRD1 P21728 1/20 0.35
SLC6A2 P23975 1/20 0.35
ADRA1A P35348 1/20 0.35
OPRM1 P35372 1/20 0.35
DRD3 P35462 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL7667036 0.96 TSHR (0.48) TSHRL3MBTL1ALDH1A1NPSR1THRB
SCHEMBL6063003 0.92 L3MBTL1 (0.44) TSHRL3MBTL1ALDH1A1NPSR1PPM1B
SCHEMBL6058467 0.85 TSHR (0.52) TSHRL3MBTL1ALDH1A1NPSR1EPHX1
SCHEMBL9451713 0.83 L3MBTL1 (0.58) TSHRL3MBTL1ALDH1A1NPSR1THRB
SCHEMBL7659987 0.83 TSHR (0.55) TSHRL3MBTL1ALDH1A1NPSR1EPHX1
SCHEMBL7654322 0.82 TSHR (0.57) TSHREPHX1
SCHEMBL7658530 0.82 TSHR (0.57) TSHREPHX1
SCHEMBL7662341 0.82 TSHR (0.57) TSHREPHX1
SCHEMBL27628754 0.80 TSHR (0.59) TSHRL3MBTL1ALDH1A1NPSR1KDM4E
SCHEMBL334541 0.79 ALDH1A1 (0.59) TSHRL3MBTL1ALDH1A1NPSR1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1283673-C Solid catalyst component for olefin polymerization IDEMITSU PETROCHEMICAL CO (JP) 2006-11-08 CN disclosed
US-7081427-B2 Solid catalyst component for olefin polymerization IDEMITSU KOSAN CO., LTD. (JP) 2006-07-25 US disclosed
CN-1561346-A Solid catalyst component for olefin polymerization IDEMITSU PETROCHEMICAL CO (JP) 2005-01-05 CN disclosed
US-20040102310-A1 Solid catalyst component for olefin polymerization IDEMITSU KOSAN CO., LTD. (JP) 2004-05-27 US disclosed
EP-1396503-A1 SOLID CATALYST COMPONENT FOR OLEFIN POLYMERIZATION IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-03-10 EP disclosed