SCHEMBL27628754

SCHEMBL27628754

CCCCOC(=O)C(C(=O)OCC)C1CCCC1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.59
ALDH1A1 P00352 3/20 0.50
NPSR1 Q6W5P4 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.47
KDM4E B2RXH2 1/20 0.43
EPHX2 P34913 1/20 0.41

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
SCHEMBL6058467 0.95 TSHR (0.52) TSHRALDH1A1NPSR1L3MBTL1EPHX2
SCHEMBL7659987 0.90 TSHR (0.55) TSHRALDH1A1NPSR1L3MBTL1EPHX2
SCHEMBL7658530 0.88 TSHR (0.57) TSHREPHX2
SCHEMBL7654322 0.88 TSHR (0.57) TSHREPHX2
SCHEMBL7662341 0.88 TSHR (0.57) TSHREPHX2
SCHEMBL334541 0.88 ALDH1A1 (0.59) TSHRALDH1A1NPSR1L3MBTL1KDM4E
SCHEMBL31409193 0.86 ALDH1A1 (0.62) TSHRALDH1A1NPSR1L3MBTL1KDM4E
SCHEMBL1433202 0.86 ALDH1A1 (0.62) TSHRALDH1A1NPSR1L3MBTL1KDM4E
SCHEMBL18022794 0.86 ALDH1A1 (0.62) TSHRALDH1A1NPSR1L3MBTL1KDM4E
SCHEMBL17793351 0.86 ALDH1A1 (0.62) TSHRALDH1A1NPSR1L3MBTL1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1735632-A catalyst for olefin polymerization and process for producing olefin polymer IDEMITSU PETROCHEMICAL CO (JP) 2006-02-15 CN disclosed