SCHEMBL16059176

SCHEMBL16059176

Cn1c(=O)c2c(nc(SCCCC(=O)O)n2Cc2cccc(Br)c2)n(C)c1=O

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.62
ALDH1A1 P00352 3/20 0.62
GAA P10253 1/20 0.62
MAOA P21397 2/20 0.62
MAOB P27338 2/20 0.62
SMN1; SMN2 Q16637 3/20 0.57
TSHR P16473 2/20 0.57
MAPT P10636 3/20 0.56
PLD3 Q8IV08 1/20 0.55
MAPK1 P28482 3/20 0.55
POLB P06746 1/20 0.55
BRAF P15056 2/20 0.55
PIK3CG P48736 1/20 0.55
KMT2A Q03164 1/20 0.54
NPSR1 Q6W5P4 2/20 0.54
TP53 P04637 1/20 0.54
HTT P42858 1/20 0.53

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
SCHEMBL3376394 0.89 BRAF (0.54) LMNAALDH1A1GAAMAOAMAOB
SCHEMBL16029365 0.86 MAOA (0.63) LMNAALDH1A1GAAMAOAMAOB
SCHEMBL16079502 0.86 MAOB (0.63) LMNAALDH1A1GAAMAOAMAOB
SCHEMBL17772706 0.85 MAOA (0.74) LMNAALDH1A1GAAMAOAMAOB
SCHEMBL16030391 0.84 MAOA (0.61) LMNAALDH1A1GAAMAOAMAOB
SCHEMBL16029594 0.83 MAOA (0.60) LMNAALDH1A1GAAMAOAMAOB
SCHEMBL16029599 0.83 MAOB (0.63) LMNAALDH1A1GAAMAOAMAOB
SCHEMBL16079496 0.82 LMNA (0.68) LMNAALDH1A1GAAMAOAMAOB
SCHEMBL16122851 0.82 MAPT (0.63) LMNAALDH1A1MAOAMAOBSMN1; SMN2
SCHEMBL16079488 0.81 MAOB (0.62) LMNAALDH1A1GAAMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2968257-A1 METHODS AND COMPOSITONS FOR IMPROVING COGNITIVE FUNCTION The Johns Hopkins University (US) 2016-01-20 EP disclosed
EP-2968220-A1 METHODS AND COMPOSITIONS FOR IMPROVING COGNITIVE FUNCTION Agenebio, Inc. (US) 2016-01-20 EP disclosed
WO-2014144546-A1 METHODS AND COMPOSITONS FOR IMPROVING COGNITIVE FUNCTION THE JOHNS HOPKINS UNIVERSITY (US) 2014-09-18 WO disclosed
WO-2014144801-A1 METHODS AND COMPOSITIONS FOR IMPROVING COGNITIVE FUNCTION AGENEBIO INC. (US) 2014-09-18 WO disclosed