SCHEMBL9839274

SCHEMBL9839274

CCN(CC)C(=O)C1CCN(C)C1=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.38
TSPO P30536 1/20 0.38
ALDH1A1 P00352 4/20 0.37
LMNA P02545 1/20 0.37
HTR1A P08908 1/20 0.37
KDM4E B2RXH2 3/20 0.36
PKM P14618 1/20 0.35
HPGD P15428 1/20 0.34
HTT P42858 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
SCHEMBL25675604 0.85 BCHE (0.40) BCHE
SCHEMBL6263411 0.80 BCHE (0.33) BCHE
SCHEMBL15763353 0.77 CHRNB2 (0.33) ALDH1A1
SCHEMBL25667127 0.77 CHRNB2 (0.33) ALDH1A1
SCHEMBL25672289 0.77 CHRNB2 (0.33) ALDH1A1
SCHEMBL11674770 0.74 CHRNB2 (0.31)
SCHEMBL783029 0.74 CDC42 (0.33)
SCHEMBL2411322 0.74 BRD4 (0.31)
SCHEMBL3913430 0.72 MEN1 (0.52) ALDH1A1KDM4EPKMHPGDHTT
SCHEMBL2018376 0.72 SMN1; SMN2 (0.34) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5059220-A COMPOSITE POLYMERIC MEMBRANES FOR THE SEPARATION OF MIXTURES OF GASES AND THE METHOD OF PREPARATION THE SAME CESKOSLOVENSKA AKADEMIE VED (CS) 1991-10-22 US disclosed