SCHEMBL15225167

SCHEMBL15225167

C=CCCCCCCC=C(C)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
MAPT P10636 3/20 0.39
ABCC4 O15439 1/20 0.39
ALDH1A1 P00352 4/20 0.38
LMNA P02545 2/20 0.38
USP2 O75604 4/20 0.38
CYP3A4 P08684 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
RECQL P46063 1/20 0.38
HPGD P15428 1/20 0.37
LPAR3 Q9UBY5 2/20 0.34
LPAR2 Q9HBW0 1/20 0.34
TRPA1 O75762 1/20 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
SCHEMBL11973141 0.80 EP300 (0.47) TSHRMAPTLMNAUSP2CYP3A4
SCHEMBL11973124 0.80 EP300 (0.47) TSHRMAPTLMNAUSP2CYP3A4
SCHEMBL11973121 0.80 EP300 (0.47) TSHRMAPTLMNAUSP2CYP3A4
SCHEMBL11973145 0.80 EP300 (0.47) TSHRMAPTLMNAUSP2CYP3A4
SCHEMBL11973439 0.77 EP300 (0.43) TSHRMAPTLMNAUSP2CYP3A4
SCHEMBL4820549 0.77
SCHEMBL11973443 0.77 EP300 (0.43) TSHRMAPTLMNAUSP2CYP3A4
SCHEMBL383195 0.77 TSHR (0.52) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL7645599 0.77 TSHR (0.52) TSHRMAPTABCC4ALDH1A1LMNA
SCHEMBL1824796 0.77 TSHR (0.52) TSHRMAPTABCC4ALDH1A1LMNA

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
EP-1456255-B1 PRODUCTION OF OLEFIN POLYMERISATION CATALYSTS BOREALIS TECH OY (FI) 2013-09-04 EP disclosed