SCHEMBL8764682

SCHEMBL8764682

CC(C(=O)O)C(N)(CCCCN)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ODC1 P11926 2/20 0.55
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53
RAB9A P51151 1/20 0.53
BLM P54132 1/20 0.53
PMP22 Q01453 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ARG1 P05089 4/20 0.49
ARG2 P78540 3/20 0.49
GSR P00390 1/20 0.38
FDPS P14324 2/20 0.37
RNPEP Q9H4A4 1/20 0.37
GABRR1 P24046 2/20 0.36
CYP2D6 P10635 1/20 0.34
NFKB1 P19838 1/20 0.34
CPB2 Q96IY4 1/20 0.34

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
SCHEMBL10653533 0.85 ARG1 (0.66) ODC1KDM4ELMNAMAPTRAB9A
SCHEMBL10653529 0.85 ARG1 (0.66) ODC1KDM4ELMNAMAPTRAB9A
SCHEMBL22009378 0.83 ODC1 (0.56) ODC1KDM4ELMNAMAPTRAB9A
SCHEMBL9501852 0.83 ODC1 (0.56) ODC1KDM4ELMNAMAPTRAB9A
SCHEMBL22009371 0.83 ODC1 (0.56) ODC1KDM4ELMNAMAPTRAB9A
SCHEMBL28035045 0.81 ODC1 (0.58) ODC1KDM4ELMNAMAPTRAB9A
SCHEMBL1495139 0.81 ODC1 (0.58) ODC1KDM4ELMNAMAPTRAB9A
Water SCHEMBL28487502 0.79 ODC1 (0.56) ODC1KDM4ELMNAMAPTRAB9A
Water SCHEMBL28487504 0.79 ODC1 (0.56) ODC1KDM4ELMNAMAPTRAB9A
SCHEMBL28218941 0.79 ODC1 (0.66) ODC1KDM4ELMNAMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0784792-A2 PROCESS OF INVESTIGATING THE INTERACTION BETWEEN BIOMOLECULES BY MEANS OF SURFACE PLASMON RESONANCE BOEHRINGER INGELHEIM INTERNATIONAL GmbH (DE) 1997-07-23 EP claimed
WO-1996009547-A2 PROCESS OF INVESTIGATING THE INTERACTION BETWEEN BIOMOLECULES BY MEANS OF SURFACE PLASMON RESONANCE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 1996-03-28 WO claimed
CN-1158658-A Process of investigating the interaction between biomolecules by means of surface plasmon resonance BOEHRINGER INGELHEIM INT (DE) 1997-09-03 CN disclosed
EP-0784792-A2 PROCESS OF INVESTIGATING THE INTERACTION BETWEEN BIOMOLECULES BY MEANS OF SURFACE PLASMON RESONANCE BOEHRINGER INGELHEIM INTERNATIONAL GmbH (DE) 1997-07-23 EP disclosed
WO-1996009547-A2 PROCESS OF INVESTIGATING THE INTERACTION BETWEEN BIOMOLECULES BY MEANS OF SURFACE PLASMON RESONANCE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 1996-03-28 WO disclosed