SCHEMBL11297096

SCHEMBL11297096

C=C(C)C(=O)N1CN(C(=O)CCC)CN(C(=O)C(=C)C)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.42
CHRNA3 P32297 1/20 0.42
CHRNA4 P43681 1/20 0.42
CHRNB3 Q05901 1/20 0.42
CHRNA6 Q15825 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
POLB P06746 3/20 0.35
MAPT P10636 2/20 0.32
GNAI3 P08754 2/20 0.32
GNAI1 P63096 2/20 0.32
CES2 O00748 1/20 0.31
CES1 P23141 1/20 0.31
GNAO1 P09471 1/20 0.30
FFAR3 O14843 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30

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
SCHEMBL14532731 0.83 CHRNB2 (0.54) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL2463953 0.81 TDP1 (0.38) TDP1
SCHEMBL14950456 0.77 CHRNB2 (0.48) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL24699950 0.74 CHRNB2 (0.46) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL11125464 0.71 L3MBTL1 (0.55) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL22942175 0.71 CHRNB2 (0.43) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL10663507 0.69 L3MBTL1 (0.58) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL674671 0.69
SCHEMBL22941346 0.69 ALDH1A1 (0.47) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6
SCHEMBL24696089 0.69 CHRNB2 (0.42) CHRNB2CHRNA3CHRNA4CHRNB3CHRNA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0013267-B1 METHOD OF MAKING LAMINATED PRODUCTS Österreichisches Forschungszentrum Seibersdorf Ges.m.b.H. (AT) 1982-06-23 EP disclosed
EP-0013267-A1 Method of making laminated products Österreichisches Forschungszentrum Seibersdorf Ges.m.b.H. (AT) 1980-07-09 EP disclosed