SCHEMBL21708185

SCHEMBL21708185

C/C=C1/C=C(/C=C/c2ccc(N(CCO)CCO)cc2)CC(C)(C)C1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
APP P05067 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
SCHEMBL8977050 0.88 MEN1 (0.32) MEN1ALDH1A1KMT2A
SCHEMBL12521242 0.85 KMT2A (0.50) MEN1ALDH1A1KMT2AAPP
SCHEMBL21678294 0.85 KMT2A (0.50) MEN1ALDH1A1KMT2AAPP
SCHEMBL14328150 0.79 CHRM2 (0.31)
SCHEMBL12482005 0.75 ALDH1A1 (0.37) MEN1ALDH1A1KMT2AAPP
SCHEMBL9915630 0.73 APP (0.42) MEN1ALDH1A1KMT2AAPP
SCHEMBL9915609 0.73 APP (0.42) MEN1ALDH1A1KMT2AAPP
SCHEMBL7718268 0.73 APP (0.42) MEN1ALDH1A1KMT2AAPP
SCHEMBL14320256 0.73 ALDH1A1 (0.44) MEN1ALDH1A1KMT2AAPP
SCHEMBL14320257 0.73 ALDH1A1 (0.44) MEN1ALDH1A1KMT2AAPP

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-20200048428-A1 ARTICLES AND COMPOSITIONS COMPRISING HOST POLYMERS AND CHROMOPHORES AND METHODS OF PRODUCING THE SAME GENERAL DYNAMICS MISSION SYSTEMS, INC. 2020-02-13 US disclosed