SCHEMBL22649779

SCHEMBL22649779

CCCCNc1c(N(C)CC)c(=O)c1=S

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
MAPT P10636 3/20 0.35
KDM4E B2RXH2 3/20 0.33
GAA P10253 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
APAF1 O14727 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ADAMTS5 Q9UNA0 1/20 0.31
MCL1 Q07820 1/20 0.30
CYP1A2 P05177 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
SCHEMBL22645832 0.95 GPR84 (0.33) ALDH1A1MAPTADAMTS5
SCHEMBL21842842 0.90 KDM4E (0.31) KDM4EGAA
SCHEMBL21842648 0.87 ALDH1A1 (0.35) ALDH1A1MAPTKDM4EGAAMEN1
SCHEMBL22649778 0.87 ALDH1A1 (0.36) ALDH1A1MAPTKDM4EGAAMEN1
SCHEMBL22645965 0.85 ALDH1A1 (0.35) ALDH1A1MAPTKDM4EGAAMEN1
SCHEMBL21473487 0.85
SCHEMBL21842762 0.85 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EGAAMEN1
SCHEMBL22646017 0.85 SMN1; SMN2 (0.35) ALDH1A1MAPTL3MBTL1TDP1SMN1; SMN2
SCHEMBL23733306 0.84
SCHEMBL21842839 0.84

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021155267-A2 MRNAS ENCODING METABOLIC REPROGRAMMING POLYPEPTIDES AND USES THEREOF MODERNATX, INC. (US) 2021-08-05 WO disclosed
WO-2020227510-A1 POLYNUCLEOTIDES FOR DISRUPTING IMMUNE CELL ACTIVITY AND METHODS OF USE THEREOF MODERNATX, INC. (US) 2020-11-12 WO disclosed