SCHEMBL5528989

SCHEMBL5528989

CCCC(C)[CH]CCCC(CC)CC

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
CYP3A4 P08684 2/20 0.35
TSHR P16473 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.31
CA2 P00918 1/20 0.31

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
SCHEMBL3267922 0.82 LMNA (0.35)
SCHEMBL7173408 0.81 TSHR (0.38) ALDH1A1TSHR
SCHEMBL9577267 0.79 TSHR (0.39) ALDH1A1TSHR
SCHEMBL1901583 0.77 TSHR (0.42) TSHR
SCHEMBL9442352 0.77 TSHR (0.42) TSHR
SCHEMBL4620039 0.76
SCHEMBL11399316 0.75 ALDH1A1 (0.43) ALDH1A1TDP1CYP3A4TSHRL3MBTL1
SCHEMBL4448836 0.73 TSHR (0.33) TSHR
SCHEMBL20605268 0.72 TSHR (0.38) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL306122 0.71 LMNA (0.33) TSHR

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
US-20070213206-A1 MAGNESIUM COMPOUND, SOLID CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, AND METHOD FOR PRODUCING POLYOLEFIN IDEMITSU KOSAN CO.,LTD (JP) 2007-09-13 US disclosed