SCHEMBL23977438

SCHEMBL23977438

Cc1ccc(SOCc2ccc(Br)cn2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.36
ALDH1A1 P00352 3/20 0.35
MBOAT4 Q96T53 1/20 0.34
MAPT P10636 3/20 0.33
GRM2 Q14416 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAOB P27338 1/20 0.32
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
MITF O75030 1/20 0.31
ATM Q13315 1/20 0.31
ALOX5AP P20292 5/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL23977291 0.78 GRM5 (0.32) MAPTHPGD
SCHEMBL20373738 0.77 GBA1 (0.42) GBA1ALDH1A1MBOAT4GRM2SMN1; SMN2
SCHEMBL20387984 0.75 SYK (0.52) ALDH1A1MAPTSMN1; SMN2LMNAL3MBTL1
SCHEMBL23977388 0.74 ALDH1A1 (0.40) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL1855342 0.71 GBA1 (0.46) GBA1ALDH1A1MBOAT4MAPTGRM2
SCHEMBL17664387 0.70 KEAP1 (0.43) GBA1ALDH1A1MBOAT4MAPTGRM2
SCHEMBL1816193 0.68 GBA1 (0.47) GBA1ALDH1A1MBOAT4MAPTGRM2
SCHEMBL11926924 0.68 GBA1 (0.41) GBA1ALDH1A1MBOAT4GRM2SMN1; SMN2
SCHEMBL2515176 0.67 GBA1 (0.42) GBA1ALDH1A1MBOAT4GRM2SMN1; SMN2
SCHEMBL15510613 0.66 ACHE (0.40) ALDH1A1MAPTHPGDDRD2DRD4

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-2021219813-A1 ANTIBACTERIAL AND ANTIFUNGAL PLEUROMUTILIN CONJUGATES SYDDANSK UNIVERSITET (DK) 2021-11-04 WO disclosed