SCHEMBL6384273

SCHEMBL6384273

O=C(OCCC=CCl)OCCC=CCl

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL10947979 0.75 ALDH1A1 (0.38) ALDH1A1
SCHEMBL10947988 0.75 ALDH1A1 (0.38) ALDH1A1
SCHEMBL6945278 0.73 ADORA3 (0.44) ALDH1A1
SCHEMBL28231787 0.73 ADORA3 (0.44) ALDH1A1
SCHEMBL6945280 0.73 ADORA3 (0.44) ALDH1A1
SCHEMBL29065669 0.73 ALDH1A1 (0.38) ALDH1A1
SCHEMBL47886 0.70 CA2 (0.42) ALDH1A1
SCHEMBL6648981 0.70 ALOX15 (0.34) ALDH1A1
SCHEMBL6331899 0.69
SCHEMBL9460960 0.69 ALDH1A1 (0.50) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1501846-A1 TRICYCLIC MACROLIDE ANTIBACTERIAL COMPOUNDS Abbott Laboratories (US) 2005-02-02 EP disclosed
WO-2003093289-A1 TRICYCLIC MACROLIDE ANTIBACTERIAL COMPOUNDS ABBOTT LABORATORIES (US) 2003-11-13 WO disclosed