SCHEMBL5791585

SCHEMBL5791585

[c]1ncnc2scc(-c3ccc(N4CCOCC4)cc3)c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
HTT P42858 5/20 0.51
KDM4E B2RXH2 5/20 0.51
SMN1; SMN2 Q16637 7/20 0.50
LMNA P02545 5/20 0.50
ALDH1A1 P00352 4/20 0.50
HPGD P15428 4/20 0.50
TDP1 Q9NUW8 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
PKM P14618 1/20 0.50
BTK Q06187 1/20 0.41
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
POLB P06746 1/20 0.40
CNR2 P34972 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39

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
SCHEMBL2368945 0.77 MAPT (0.53) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL2369510 0.76 SMN1; SMN2 (0.52) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL2369061 0.75 FGFR1 (0.50) HTTKDM4ESMN1; SMN2LMNAHPGD
SCHEMBL2369522 0.72 MAPT (0.38) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL5788742 0.72 MAPT (0.56) MAPTHTTLMNAALDH1A1HPGD
SCHEMBL5803878 0.71 HTT (0.47) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL2368757 0.69 LMNA (0.47) MAPTHTTSMN1; SMN2LMNAALDH1A1
SCHEMBL5791688 0.69 LMNA (0.52) MAPTHTTKDM4ESMN1; SMN2LMNA
SCHEMBL27909495 0.68 STK17B (0.51) MAPTKDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL2368088 0.66 HTT (0.45) MAPTHTTSMN1; SMN2BTKKMT2A

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
EP-1641803-A1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS Xention Discovery Limited (GB) 2006-04-05 EP disclosed
WO-2004111057-A1 THIENOPYRIMIDINE DERIVATIVES AS POTASSIUM CHANNEL INHIBITORS XENTION DISCOVERY LIMITED (GB) 2004-12-23 WO disclosed