SCHEMBL30688346

SCHEMBL30688346

CCCCSSSc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.42
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MGLL Q99685 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ALDH1A1 P00352 4/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MAPK1 P28482 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
PTGS2 P35354 3/20 0.33
LMNA P02545 1/20 0.33
PAX8 Q06710 1/20 0.33
S100A4 P26447 1/20 0.33
SOAT1 P35610 1/20 0.33
PCSK9 Q8NBP7 1/20 0.33
LTA4H P09960 1/20 0.33
KDM4E B2RXH2 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TLR8 Q9NR97 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
SCHEMBL576770 0.88 MAPT (0.46) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL5071818 0.82 MAPT (0.44) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL8575122 0.80 SMN1; SMN2 (0.42) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL7165247 0.80 SMN1; SMN2 (0.42) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL11619624 0.80 SMN1; SMN2 (0.42) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL11645718 0.80 SMN1; SMN2 (0.42) MAPTHPGDSMN1; SMN2MGLLHSD17B10
Hexane SCHEMBL17505032 0.78 SMN1; SMN2 (0.63) MAPTHPGDSMN1; SMN2MGLLHSD17B10
SCHEMBL30596833 0.77 HSD11B1 (0.46) HPGDSMN1; SMN2HSD17B10ALDH1A1PTGS2
SCHEMBL30688344 0.74 CTSB (0.41) SMN1; SMN2ALDH1A1NPSR1MAPK1
SCHEMBL575895 0.74 ALDH1A1 (0.64) MAPTALDH1A1NPSR1MAPK1NPC1

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-117003968-A Star-shaped block copolymer and preparation method and application thereof 深圳好电科技有限公司 2023-11-07 CN claimed
CN-117003968-A Star-shaped block copolymer and preparation method and application thereof 深圳好电科技有限公司 2023-11-07 CN disclosed