SCHEMBL766293

SCHEMBL766293

CC(C(=O)O)C(=O)NCCCN

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 2/20 0.44
GNAI3 P08754 1/20 0.44
GNAO1 P09471 1/20 0.44
GNAI1 P63096 1/20 0.44
DPP7 Q9UHL4 2/20 0.43
RRM1 P23921 1/20 0.42
SIRT6 Q8N6T7 1/20 0.40
SIRT1 Q96EB6 1/20 0.40
GABRR1 P24046 2/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A2 O94788 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ALDH2 P05091 1/20 0.38
ALDH1A3 P47895 1/20 0.38
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
CHRNB2 P17787 1/20 0.36

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
SCHEMBL766365 0.88 GABRR1 (0.46) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL27991817 0.82 FNTA (0.49) DPP7RRM1FNTAFNTB
SCHEMBL823169 0.81 CYP2D6 (0.50) PAOXGNAI3GNAO1GNAI1DPP7
SCHEMBL10629970 0.80 FNTA (0.56) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL9497692 0.79 KMT2A (0.53) PAOXGNAI3GNAO1GNAI1DPP7
SCHEMBL8354456 0.79 DPP7 (0.50) PAOXGNAI3GNAO1GNAI1DPP7
Oxalic Acid SCHEMBL9795099 0.78 KMT2A (0.48) PAOXGNAI3GNAO1GNAI1DPP7
SCHEMBL25935680 0.78 PAOX (0.52) PAOXGNAI3GNAO1GNAI1DPP7
SCHEMBL18532434 0.78 PAOX (0.45) PAOXGNAI3GNAO1GNAI1DPP7
SCHEMBL13219110 0.76 DPP7 (0.41) PAOXGNAI3GNAO1GNAI1DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120067821-A1 Filter Medium For Leukocyte Removal CHUNG YUAN CHRISTIAN UNIVERSITY (TW) 2012-03-22 US claimed
CN-102397724-A Leukocyte filtering material and filtering method thereof UNIV CHUNG YUAN CHRISTIAN 2012-04-04 CN disclosed
US-20120067821-A1 Filter Medium For Leukocyte Removal CHUNG YUAN CHRISTIAN UNIVERSITY (TW) 2012-03-22 US disclosed