SCHEMBL8928209

SCHEMBL8928209

NCCC(CCN)(CCCC(N)=O)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
FDPS P14324 4/20 0.34
LMNA P02545 3/20 0.34
PDE3A Q14432 2/20 0.34
ADRB3 P13945 1/20 0.34
PDE4D Q08499 1/20 0.34
HDAC6 Q9UBN7 2/20 0.33
THRB P10828 2/20 0.33
BLM P54132 2/20 0.33
KMT2A Q03164 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
GABRR3 A8MPY1 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
HDAC3 O15379 1/20 0.33
GABBR2 O75899 1/20 0.33
CYP1A2 P05177 1/20 0.33
GABRA1 P14867 1/20 0.33
TSHR P16473 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
SCHEMBL8928211 0.91 MAOA (0.41) MAOAMAOBFDPSLMNAHDAC6
SCHEMBL28960434 0.84 CYP4F2 (0.37)
SCHEMBL3874514 0.84
SCHEMBL27972466 0.82
SCHEMBL7760144 0.82 SOAT1 (0.44) FDPSKMT2ACYP1A2MEN1ALDH1A1
SCHEMBL28232739 0.82 FOLH1 (0.30)
SCHEMBL4147412 0.79 CYP4F2 (0.37) FDPSTHRBKMT2ACYP1A2MEN1
SCHEMBL5974471 0.79 SOAT1 (0.50) FDPSKMT2ACYP1A2MEN1
SCHEMBL7737179 0.79 SOAT1 (0.50) FDPSKMT2ACYP1A2MEN1
SCHEMBL28111259 0.77 PAOX (0.37) CYP1A2TSHRPAOXALDH1A1

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-0495269-B1 Thermosetting reactive resin mixture, moulded article and coating made therefrom DAINIPPON INK & CHEMICALS (JP) 1997-03-05 EP disclosed
US-5292833-A Polyepoxide compound, carbamate compound and catalyst DAINIPPON INK AND CHEMICALS, INC. (JP) 1994-03-08 US disclosed
WO-1992012192-A2 THERMOSETTING REACTIVE RESIN MIXTURE, MOULDED ARTICLE AND COATING MADE THEREFROM DAINIPPON INK & CHEMICALS, INC. (JP) 1992-07-23 WO disclosed
EP-0495269-A2 Thermosetting reactive resin mixture, moulded article and coating made therefrom DAINIPPON INK AND CHEMICALS, INC. (JP) 1992-07-22 EP disclosed