SCHEMBL5263072

SCHEMBL5263072

COC1Cc2ccccc2/C1=N/O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.39
HRH4 Q9H3N8 2/20 0.39
ACHE P22303 1/20 0.37
HPGD P15428 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
TSHR P16473 1/20 0.34
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RAB9A P51151 1/20 0.32
LMNA P02545 1/20 0.32
METAP1 P53582 1/20 0.32
DRD2 P14416 1/20 0.32
DRD1 P21728 1/20 0.32
HTR2C P28335 1/20 0.32

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
SCHEMBL5263075 1.00 HRH1 (0.39) HRH1HRH4ACHEHPGDL3MBTL1
SCHEMBL6181741 0.83 HPGD (0.41) HRH1HRH4HPGDL3MBTL1ALDH1A1
SCHEMBL5400815 0.79 HRH1 (0.35) HRH1HRH4ACHEL3MBTL1ALDH1A1
SCHEMBL354099 0.77 ACHE (0.53) ACHEHPGDL3MBTL1ALDH1A1CYP1A2
SCHEMBL354098 0.77 ACHE (0.53) ACHEHPGDL3MBTL1ALDH1A1CYP1A2
SCHEMBL5970427 0.77 ACHE (0.53) ACHEHPGDL3MBTL1ALDH1A1CYP1A2
SCHEMBL29410363 0.77 ACHE (0.53) ACHEHPGDL3MBTL1ALDH1A1CYP1A2
SCHEMBL6947493 0.74 MEN1 (0.39) ACHEL3MBTL1ALDH1A1TSHRSMN1; SMN2
SCHEMBL6947489 0.74 MEN1 (0.39) ACHEL3MBTL1ALDH1A1TSHRSMN1; SMN2
SCHEMBL7230533 0.74 HPGD (0.40) HRH1HRH4ACHEHPGDL3MBTL1

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-1836161-A2 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES Neurochem (International) Limited (CH) 2007-09-26 EP disclosed
WO-2006085149-A2 METHODS AND COMPOSITIONS FOR TREATING AMYLOID-RELATED DISEASES NEUROCHEM (INTERNATIONAL) LIMITED (CH) 2006-08-17 WO disclosed