SCHEMBL28291658

SCHEMBL28291658

CCNCCc1cc[c]cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 5/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
HTR2A P28223 2/20 0.36
TAAR1 Q96RJ0 4/20 0.35
ATM Q13315 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA4 P22748 1/20 0.35
HTR1A P08908 1/20 0.35
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
HTR1E P28566 1/20 0.35
HTR7 P34969 1/20 0.35
HTR2B P41595 1/20 0.35
HTR5A P47898 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 1/20 0.33

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
SCHEMBL17731 0.79
SCHEMBL8410233 0.77 TAAR1 (0.60) SIGMAR1L3MBTL1MAPTTAAR1ATM
SCHEMBL2481506 0.77 LMNA (0.39) L3MBTL1GAAMAPTHTR2AHTR1A
SCHEMBL1406143 0.77 SIGMAR1 (0.64) SIGMAR1L3MBTL1GAAMAPTTAAR1
SCHEMBL28265916 0.77 SIGMAR1 (0.50) SIGMAR1CA12CA1CA2CA4
SCHEMBL5132875 0.77 SIGMAR1 (0.41) SIGMAR1GAAMAPTSMN1; SMN2
SCHEMBL27871034 0.77 LPL (0.43) L3MBTL1GAACA2HTR1D
SCHEMBL28021975 0.77 LPL (0.43) L3MBTL1GAACA2HTR1D
SCHEMBL5128262 0.76 GAA (0.43) SIGMAR1L3MBTL1GAA
SCHEMBL17922520 0.76 TAAR1 (0.59) SIGMAR1L3MBTL1MAPTTAAR1ATM

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
CN-109641848-A It can electropolarized compound and capacitor 电容器科学股份公司 2019-04-16 CN disclosed