SCHEMBL15065348

SCHEMBL15065348

OCCN(CCO)CCN1CCN(CCN2CCN(CCO)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
KMT2A Q03164 4/20 0.38
LMNA P02545 2/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2D6 P10635 1/20 0.34
DUSP3 P51452 1/20 0.34
PTPN5 P54829 1/20 0.34
PTPN11 Q06124 1/20 0.34
PKM P14618 2/20 0.33
HSD17B10 Q99714 2/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD11B1 P28845 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33

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
SCHEMBL16075891 0.95 ALDH1A1 (0.45) ALDH1A1KDM4EKMT2ALMNAHTT
SCHEMBL16075890 0.85 KDM4E (0.37) ALDH1A1KDM4EKMT2ALMNAHTT
SCHEMBL2845937 0.84 PAOX (0.37) ALDH1A1KDM4ELMNAHTTHPGD
SCHEMBL13187897 0.84 PAOX (0.37) ALDH1A1KDM4ELMNAHTTHPGD
SCHEMBL11199088 0.84 HRH3 (0.39) ALDH1A1KMT2ALMNAMEN1CYP2C19
SCHEMBL17539388 0.84 HRH3 (0.39) ALDH1A1KMT2ALMNAMEN1CYP2C19
SCHEMBL13187933 0.83 KDM4E (0.57) ALDH1A1KDM4EKMT2ADUSP3HSD17B10
SCHEMBL14980601 0.83 ALOX15 (0.42) ALDH1A1KDM4EALOX15
SCHEMBL30425835 0.83 KDM4E (0.33) ALDH1A1KDM4EKMT2APKM
SCHEMBL17528476 0.82 HRH3 (0.37) ALDH1A1KMT2ALMNAMEN1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9611351-B2 Amine polyether polyols and polyurethane foam compositions made from cyclic amine compounds DOW GLOBAL TECHNOLOGIES LLC. (US) 2017-04-04 US claimed
US-20140357750-A1 AMINE POLYETHER POLYOLS AND POLYURETHANE FOAM COMPOSITIONS MADE FROM CYCLIC AMINE COMPOUNDS DOW GLOBAL TECHNOLOGIES LLC (US) 2014-12-04 US claimed
EP-2797903-B1 AMINE POLYETHER POLYOLS AND POLYURETHANE FOAM COMPOSITIONS MADE FROM CYCLIC AMINE COMPOUNDS DOW GLOBAL TECHNOLOGIES LLC (US) 2017-05-17 EP disclosed
US-9611351-B2 Amine polyether polyols and polyurethane foam compositions made from cyclic amine compounds DOW GLOBAL TECHNOLOGIES LLC. (US) 2017-04-04 US disclosed
EP-2797903-A1 AMINE POLYETHER POLYOLS AND POLYURETHANE FOAM COMPOSITIONS MADE FROM CYCLIC AMINE COMPOUNDS Dow Global Technologies LLC (US) 2014-11-05 EP disclosed
WO-2013102053-A1 AMINE POLYETHER POLYOLS AND POLYURETHANE FOAM COMPOSITIONS MADE FROM CYCLIC AMINE COMPOUNDS DOW GLOBAL TECHNOLOGIES LLC (US) 2013-07-04 WO disclosed