SCHEMBL6567713

SCHEMBL6567713

[c]1ccccc1C1(c2ccccc2C2(c3[c]cccc3)CCCCC2)CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PGR P06401 3/20 0.34
HTR2A P28223 1/20 0.32
PDE7A Q13946 1/20 0.32
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 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
SCHEMBL379632 0.90 ESR1 (0.34) ALDH1A1L3MBTL1ESR1ESR2SLC6A2
SCHEMBL5135074 0.83 OPRM1 (0.38) ALDH1A1L3MBTL1ESR1ESR2SLC6A2
SCHEMBL25673 0.78 SLC6A4 (0.31) SLC6A2SLC6A4SLC6A3
SCHEMBL6838754 0.76 ALDH1A1 (0.42) HTR2APDE7AALDH1A1L3MBTL1ESR1
SCHEMBL19405487 0.74
SCHEMBL19405562 0.74
SCHEMBL169859 0.74 ALDH1A1 (0.37) ALDH1A1
SCHEMBL19405672 0.74
SCHEMBL3539518 0.73 AKR1C1 (0.55) L3MBTL1
SCHEMBL19405503 0.72

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-1402949-A1 Metal complexes containing bis(iminophosphorane) ligands, process for their preparation and process for the oligomerisation of olefins in the presence of these complexes Solvay Polyolefins Europe-Belgium (Société Anonyme) (BE) 2004-03-31 EP disclosed