SCHEMBL28869445

SCHEMBL28869445

C=C(CC)C(=O)OCN1CCCC1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
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
SCHEMBL28123165 0.84 TSHR (0.42) GAAKMT2AALDH1A1POLBMAPT
SCHEMBL8990128 0.81 TSHR (0.44) GAAALDH1A1POLBMAPT
SCHEMBL25166535 0.79 TSHR (0.42) GAAALDH1A1POLBMAPTMAPK1
SCHEMBL21748712 0.75 ALDH1A1 (0.46) GAAALDH1A1POLBMAPTMAPK1
SCHEMBL28869446 0.74 ALDH1A1 (0.40) GAAMEN1KMT2AALDH1A1MAPT
SCHEMBL27950637 0.73 HTT (0.30)
SCHEMBL2038297 0.73 GAA (0.41) GAAMEN1KMT2AALDH1A1POLB
SCHEMBL10937047 0.72 HTT (0.33) MEN1KMT2AALDH1A1MAPT
SCHEMBL5036796 0.71 ALDH1A1 (0.40) GAAALDH1A1POLBMAPTMAPK1
SCHEMBL28014487 0.71 ALDH1A1 (0.54) MEN1KMT2AALDH1A1POLB

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-109350847-A A kind of functionalization implanted flexible electrode and its application 深圳先进技术研究院 2019-02-19 CN claimed