SCHEMBL28957331

SCHEMBL28957331

Cc1ccc(-c2nc3ccccc3s2)c(S)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.55
KDM4E B2RXH2 7/20 0.55
NPC1 O15118 6/20 0.55
RAB9A P51151 6/20 0.55
ALDH1A1 P00352 6/20 0.55
SMN1; SMN2 Q16637 6/20 0.55
MEN1 O00255 5/20 0.55
KMT2A Q03164 5/20 0.55
GAA P10253 4/20 0.55
TDP1 Q9NUW8 4/20 0.55
L3MBTL1 Q9Y468 4/20 0.55
NPSR1 Q6W5P4 2/20 0.55
ILK Q13418 3/20 0.52
GLA P06280 2/20 0.52
HCRTR1 O43613 1/20 0.52
RXFP1 Q9HBX9 1/20 0.51
TP53 P04637 1/20 0.50
POLB P06746 3/20 0.48
APP P05067 1/20 0.48
THRB P10828 1/20 0.48

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
SCHEMBL30211740 0.84 MAPT (0.69) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL25329016 0.84 MAPT (0.69) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL7197286 0.84 MAPT (0.72) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL27969672 0.83 MAPT (0.70) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL2139104 0.83 MAPT (0.57) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL2788588 0.82 KDM4E (0.64) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL29478092 0.80 MAPT (0.71) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL2790890 0.80 MAPT (0.69) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL25327971 0.80 MAPT (0.71) MAPTKDM4ENPC1RAB9AALDH1A1
SCHEMBL27769428 0.79 MAPT (0.68) MAPTKDM4ENPC1RAB9AALDH1A1

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
CN-115702939-A Multi-target complex of cargo liposome, drug-loading platform containing multi-target complex and application of multi-target complex 杭州星鳌生物科技有限公司 2023-02-17 CN disclosed