SCHEMBL6063948

SCHEMBL6063948

CC(C)OC(=O)C(C(=O)OC(C)C)C1CCC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.42
TSHR P16473 4/20 0.39
TP53 P04637 1/20 0.38
ALDH1A1 P00352 4/20 0.36
NPSR1 Q6W5P4 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
MMP2 P08253 2/20 0.32
CA9 Q16790 2/20 0.32
EPHX1 P07099 2/20 0.32

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
SCHEMBL7667350 0.95 THRB (0.42) THRBTSHRTP53ALDH1A1NPSR1
SCHEMBL6063828 0.91 TSHR (0.42) THRBTSHRTP53ALDH1A1NPSR1
SCHEMBL28842009 0.77 TSHR (0.39) THRBTSHRTP53ALDH1A1NPSR1
SCHEMBL1986462 0.76 EPHX1 (0.40) TSHRTP53ALDH1A1NPSR1SMN1; SMN2
SCHEMBL16732257 0.76 TSHR (0.37) THRBTSHRTP53ALDH1A1NPSR1
SCHEMBL9451713 0.76 L3MBTL1 (0.58) THRBTSHRALDH1A1NPSR1L3MBTL1
SCHEMBL29220277 0.76 TSHR (0.37) THRBTSHRALDH1A1NPSR1L3MBTL1
SCHEMBL4491334 0.74 THRB (0.61) THRBTSHRTP53ALDH1A1NPSR1
SCHEMBL16732154 0.74 EPHX1 (0.39) TSHRTP53ALDH1A1NPSR1SMN1; SMN2
SCHEMBL19941727 0.73 TP53 (0.62) THRBTSHRTP53ALDH1A1NPSR1

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