SCHEMBL21243049

SCHEMBL21243049

CCN(CC)CCN1CCCN(C)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.41
CHKA P35790 3/20 0.41
CA2 P00918 1/20 0.39
NCF1 P14598 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
SLC6A3 Q01959 3/20 0.38
SLC6A4 P31645 2/20 0.38
KDM4E B2RXH2 1/20 0.38
DRD2 P14416 1/20 0.37
HTR7 P34969 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
SCHEMBL1488103 0.92 SIGMAR1 (0.38) SIGMAR1SLC6A3SLC6A4DRD2
SCHEMBL11955738 0.89 SIGMAR1 (0.46) SIGMAR1SLC6A3SLC6A4DRD2
SCHEMBL13701445 0.85 SIGMAR1 (0.50) SIGMAR1PRMT6SLC6A3SLC6A4DRD2
SCHEMBL4617835 0.83 SIGMAR1 (0.49) SIGMAR1SLC6A3SLC6A4DRD2
SCHEMBL25565976 0.82 SIGMAR1 (0.39) SIGMAR1SLC6A3SLC6A4DRD2
Hydrochloric Acid SCHEMBL11609607 0.81 SIGMAR1 (0.47) SIGMAR1SLC6A3SLC6A4DRD2
SCHEMBL2920396 0.79 CHKA (0.43) SIGMAR1CHKACA2NCF1PRMT6
SCHEMBL13882173 0.79 PAOX (0.41) SIGMAR1
SCHEMBL15401669 0.79 SIGMAR1 (0.38) SIGMAR1SLC6A3SLC6A4DRD2
SCHEMBL12156580 0.79 DRD2 (0.39) SIGMAR1SLC6A3SLC6A4DRD2

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
EP-3521272-A1 STILBENE DERIVATIVE AND METHOD FOR PREPARING SAME Ozchela Inc. (KR) 2019-08-07 EP disclosed