SCHEMBL21899889

SCHEMBL21899889

COCCCN(CC(C)O)C(C)C.COCCCN(CCO)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.36
PIK3CD O00329 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
SCHEMBL14894656 0.91 KCNA5 (0.40) KCNA5PIK3CD
SCHEMBL14895012 0.89 PIK3CD (0.33) PIK3CD
SCHEMBL16295545 0.79 PIK3CD (0.31) KCNA5PIK3CD
SCHEMBL5535647 0.78 PIK3CD (0.40) KCNA5PIK3CD
SCHEMBL14894753 0.76 PIK3CD (0.33) KCNA5PIK3CD
SCHEMBL25071621 0.76 PIK3CD (0.37) PIK3CD
SCHEMBL24424888 0.73 KCNA5 (0.36) KCNA5
SCHEMBL3431851 0.71 MEN1 (0.36)
SCHEMBL14894775 0.71 PIK3CD (0.52) KCNA5PIK3CD
SCHEMBL79660 0.71 MAPT (0.42)

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-3645605-A1 NOVEL POLYAMINES, SYNTHESIS METHOD THEREOF AND USE THEREOF FOR THE SELECTIVE ELEMINATION OF H2S FROM A GASEOUS EFFLUENT COMPRISING C02 IFP Energies nouvelles (FR) 2020-05-06 EP claimed
EP-3645605-A1 NOVEL POLYAMINES, SYNTHESIS METHOD THEREOF AND USE THEREOF FOR THE SELECTIVE ELEMINATION OF H2S FROM A GASEOUS EFFLUENT COMPRISING C02 IFP Energies nouvelles (FR) 2020-05-06 EP disclosed