SCHEMBL28870943

SCHEMBL28870943

CCON1CCCCC1C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TSHR P16473 1/20 0.35
ALDH1A1 P00352 5/20 0.33
GAA P10253 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MAOB P27338 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
MAPT P10636 1/20 0.30
CRHBP P24387 1/20 0.30
CRHR2 Q13324 1/20 0.30
MAPK1 P28482 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
SCHEMBL9368807 0.75 ALDH1A1 (0.32) ALDH1A1
SCHEMBL772897 0.75
SCHEMBL11360985 0.74 ALDH1A1 (0.34) ALDH1A1
SCHEMBL21257389 0.73 GAA (0.33) MEN1KMT2AALDH1A1GAASMN1; SMN2
SCHEMBL28710267 0.71 HRH3 (0.46) ALDH1A1GAAHPGDKDM4EHRH3
SCHEMBL4630563 0.71 HPGD (0.38) MEN1KMT2ATSHRALDH1A1GAA
SCHEMBL17029575 0.70
SCHEMBL28900176 0.70 HPGD (0.35) MEN1KMT2AALDH1A1GAASMN1; SMN2
SCHEMBL15011744 0.68
SCHEMBL3362108 0.68 HPGD (0.34) MEN1KMT2AALDH1A1GAAHPGD

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-109478472-A ELECTROLYTE FOR ELECTROCHEMICAL DEVICE, ELECTROLYTIC SOLUTION, AND ELECTROCHEMICAL DEVICE 大塚化学株式会社 2019-03-15 CN disclosed