SCHEMBL8030767

SCHEMBL8030767

NC[CH]Cc1ccc(-c2ccccc2F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
MAPT P10636 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAOB P27338 2/20 0.41
GRIA4 P48058 2/20 0.40
DAO P14920 1/20 0.40
GRM2 Q14416 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
PTPRC P08575 1/20 0.38
PTPN1 P18031 1/20 0.38
MEN1 O00255 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
MAPKAPK2 P49137 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ACMSD Q8TDX5 1/20 0.37
MME P08473 1/20 0.36
BACE1 P56817 2/20 0.36

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
SCHEMBL7409593 0.80 ALDH1A1 (0.49) ALDH1A1MAPTL3MBTL1GRIA4DAO
SCHEMBL5992486 0.80 TAAR1 (0.56) ALDH1A1MAPTL3MBTL1MAOBGRIA4
SCHEMBL27652849 0.79 ALDH1A1 (0.45) ALDH1A1MAPTL3MBTL1MAOBGRIA4
SCHEMBL28880915 0.79 ALDH1A1 (0.44) ALDH1A1MAPTL3MBTL1GRIA4DAO
SCHEMBL10436028 0.78 MAOB (0.65) ALDH1A1MAPTL3MBTL1MAOBGRIA4
SCHEMBL21235252 0.75 MAOB (0.51) ALDH1A1MAPTL3MBTL1MAOBGRIA4
SCHEMBL30920080 0.75 MAOB (0.51) ALDH1A1MAPTL3MBTL1MAOBGRIA4
SCHEMBL12856701 0.74 PTPRC (0.56) ALDH1A1MAPTL3MBTL1GRIA4PPARG
SCHEMBL16056409 0.74 ALDH1A1 (0.53) ALDH1A1MAPTL3MBTL1GRIA4DAO
SCHEMBL11452249 0.73 LOXL2 (0.54) MAOB

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
WO-2000006156-A1 AMIDE, CARBAMATE, AND UREA DERIVATIVES ELI LILLY AND COMPANY (US) 2000-02-10 WO disclosed