SCHEMBL4430508

SCHEMBL4430508

CN(C)C(=NCCCCO)N(C)C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TSHR P16473 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
SCHEMBL21477660 0.98 MIF (0.43) MIFSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL13181238 0.92 MIF (0.31) MIFALDH1A1
SCHEMBL5935349 0.89 MEN1 (0.35) MEN1KMT2A
SCHEMBL2740902 0.87 MEN1 (0.39) MEN1KMT2A
SCHEMBL5746721 0.87 MEN1 (0.39) MEN1KMT2A
SCHEMBL5935091 0.84
SCHEMBL4056657 0.81 ADRA2A (0.32)
SCHEMBL5814804 0.78 MEN1 (0.54) LMNAMEN1KMT2AALDH1A1HSD17B10
SCHEMBL5809866 0.78 MEN1 (0.54) LMNAMEN1KMT2AALDH1A1HSD17B10
SCHEMBL5306610 0.78 MEN1 (0.54) LMNAMEN1KMT2AALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2099551-A2 EXTRACTION MEDIUM USED IN A METHOD FOR CAPTURING CARBON DIOXIDE CONTAINED IN A GASEOUS EFFLUENT IFP (FR) 2009-09-16 EP claimed
WO-2008068411-A2 EXTRACTION MEDIUM USED IN A METHOD FOR CAPTURING CARBON DIOXIDE CONTAINED IN A GASEOUS EFFLUENT IFP (FR) 2008-06-12 WO claimed
EP-2099551-A2 EXTRACTION MEDIUM USED IN A METHOD FOR CAPTURING CARBON DIOXIDE CONTAINED IN A GASEOUS EFFLUENT IFP (FR) 2009-09-16 EP disclosed
WO-2008068411-A2 EXTRACTION MEDIUM USED IN A METHOD FOR CAPTURING CARBON DIOXIDE CONTAINED IN A GASEOUS EFFLUENT IFP (FR) 2008-06-12 WO disclosed