SCHEMBL5447281

SCHEMBL5447281

C=CCCCC=CCOC(COOC(=O)CCC(=O)O)OCC=CCCCC=C

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
ABCC4 O15439 1/20 0.37
LMNA P02545 2/20 0.34
USP2 O75604 1/20 0.34
CYP3A4 P08684 1/20 0.34
RECQL P46063 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL5447277 0.81 LMNA (0.41) MAPTLMNAUSP2CYP3A4RECQL
SCHEMBL5451680 0.76 MAPT (0.39) MAPTABCC4LMNAUSP2CYP3A4
SCHEMBL5447279 0.72 MAPT (0.37) MAPTABCC4LMNAUSP2CYP3A4
SCHEMBL5451678 0.70 MAPT (0.41) MAPTABCC4LMNAUSP2CYP3A4
SCHEMBL8810390 0.69 TSHR (0.44) MAPTABCC4LMNAUSP2CYP3A4
SCHEMBL8598158 0.69 TSHR (0.44) MAPTABCC4LMNAUSP2CYP3A4
SCHEMBL8661879 0.69 EGLN1 (0.38) MAPTABCC4LMNASMN1; SMN2
SCHEMBL2568525 0.68 MAPT (0.61) MAPTABCC4LMNAUSP2RECQL
SCHEMBL2568529 0.68 MAPT (0.61) MAPTABCC4LMNAUSP2RECQL
SCHEMBL3635862 0.68 MAPT (0.37) MAPTABCC4LMNAUSP2CYP3A4

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-20070060713-A1 Reactive diluents in coating formulation BP CHEMICALS LIMITED (GB) 2007-03-15 US disclosed