SCHEMBL30231024

SCHEMBL30231024

CN(C)c1cnccc1I

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.41
CHKA P35790 1/20 0.41
CHUK O15111 1/20 0.36
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HDAC8 Q9BY41 1/20 0.35
LATS1 O95835 1/20 0.33
LATS2 Q9NRM7 1/20 0.33
CHRNB2 P17787 2/20 0.32
CHRNA4 P43681 2/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
ALOX15 P16050 1/20 0.32
CASP1 P29466 1/20 0.32
RAB9A P51151 1/20 0.32
HBB P68871 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.32
ROCK2 O75116 2/20 0.32
HASPIN Q8TF76 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
SCHEMBL5700192 1.00 CHRM5 (0.41) CHRM5CHKACHUKMAPTSMN1; SMN2
SCHEMBL16701005 0.78 CHRM5 (0.46) CHRM5CHKACHUKMAPTSMN1; SMN2
SCHEMBL12497820 0.77 KDM4C (0.39) MAPTMEN1KMT2AGAA
SCHEMBL8128310 0.74 CHRM5 (0.42) CHRM5CHKACHUKMAPTSMN1; SMN2
SCHEMBL5811939 0.74 MAPK10 (0.35)
SCHEMBL23836747 0.73 CHRM5 (0.41) CHRM5CHKACHUKMAPTSMN1; SMN2
SCHEMBL827969 0.73 CHUK (0.42) CHRM5CHKACHUKMAPTSMN1; SMN2
SCHEMBL21100999 0.73 GAA (0.46) CHRM5CHKACHUKMAPTSMN1; SMN2
SCHEMBL5700599 0.73 CHRM5 (0.41) CHRM5CHKACHUKMAPTSMN1; SMN2
SCHEMBL22180254 0.71 LATS1 (0.43) LATS1LATS2CHRNB2CHRNA4

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
CN-116547275-A IL-17A modulators 赛诺菲 2023-08-04 CN disclosed
EP-4157827-A1 IL-17A MODULATORS SANOFI (FR) 2023-04-05 EP disclosed