SCHEMBL30311908

SCHEMBL30311908

CC(C)c1cccc(-c2cccc3nc(N)sc23)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASH1L Q9NR48 1/20 0.44
TGFBR1 P36897 9/20 0.39
SMN1; SMN2 Q16637 3/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SCN4A P35499 1/20 0.37
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HTR1A P08908 2/20 0.34
HTR7 P34969 2/20 0.34
DRD2 P14416 1/20 0.34
DRD1 P21728 1/20 0.34
DRD4 P21917 1/20 0.34
HTR2A P28223 1/20 0.34

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
SCHEMBL29013235 1.00 ASH1L (0.44) ASH1LTGFBR1SMN1; SMN2NPC1RAB9A
SCHEMBL29013237 0.81 ASH1L (0.47) ASH1LTGFBR1SMN1; SMN2NPC1RAB9A
SCHEMBL30312094 0.81 ASH1L (0.47) ASH1LTGFBR1SMN1; SMN2NPC1RAB9A
SCHEMBL29013285 0.77 ASH1L (0.44) ASH1LTGFBR1SMN1; SMN2NPC1RAB9A
SCHEMBL30311917 0.77 ASH1L (0.44) ASH1LTGFBR1SMN1; SMN2NPC1RAB9A
SCHEMBL31621265 0.77 ASH1L (0.44) ASH1LTGFBR1SMN1; SMN2NPC1RAB9A
SCHEMBL29013271 0.75 PIK3CD (0.55) ASH1LTGFBR1SMN1; SMN2NPC1RAB9A
SCHEMBL29013268 0.74 ASH1L (0.44) ASH1LTGFBR1SCN4APIK3CDPIK3CA
SCHEMBL30312033 0.74 ASH1L (0.44) ASH1LTGFBR1SCN4APIK3CDPIK3CA
SCHEMBL30312041 0.74 ASH1L (0.41) ASH1LSMN1; SMN2NPC1RAB9ASCN4A

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-115850263-B 2, 7-Disubstituted benzothiazole compound and application thereof 浙江工业大学 2025-06-17 CN disclosed
CN-115850263-A 2, 7-disubstituted benzothiazole compound and application thereof 浙江工业大学 2023-03-28 CN disclosed