SCHEMBL28552155

SCHEMBL28552155

Cc1ccc(-c2ccccc2S)c(-c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.50
PTGDR2 Q9Y5Y4 1/20 0.44
HDAC7 Q8WUI4 1/20 0.42
PSMB5 P28074 1/20 0.41
L3MBTL1 Q9Y468 5/20 0.39
LMNA P02545 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
MAPT P10636 2/20 0.39
ESR2 Q92731 1/20 0.39
APAF1 O14727 1/20 0.39
THRB P10828 1/20 0.39
XBP1 P17861 1/20 0.39
PTBP1 P26599 1/20 0.39
HTT P42858 1/20 0.39
GALK1 P51570 1/20 0.39
BLM P54132 1/20 0.39

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
SCHEMBL10433952 0.88 ELANE (0.56) ELANEPTGDR2HDAC7PSMB5L3MBTL1
SCHEMBL7434020 0.84 HDAC7 (0.47) ELANEPTGDR2HDAC7PSMB5L3MBTL1
Lithium SCHEMBL31260751 0.84 ELANE (0.50) ELANEPTGDR2HDAC7PSMB5L3MBTL1
SCHEMBL3005820 0.82 ELANE (0.52) ELANEPTGDR2HDAC7PSMB5L3MBTL1
SCHEMBL10629178 0.80 ESR2 (0.48) ELANEPTGDR2HDAC7PSMB5L3MBTL1
Hydrogen Sulfide SCHEMBL27603601 0.80 ELANE (0.50) ELANEPTGDR2HDAC7PSMB5L3MBTL1
SCHEMBL8056200 0.80 ELANE (0.50) ELANEPTGDR2HDAC7PSMB5L3MBTL1
SCHEMBL12610859 0.80 ALDH1A1 (0.44) PTGDR2L3MBTL1LMNAMEN1KMT2A
SCHEMBL4669357 0.80 ALDH1A1 (0.44) PTGDR2L3MBTL1LMNAMEN1KMT2A
SCHEMBL16548116 0.79 ELANE (0.50) ELANEL3MBTL1LMNAMEN1KMT2A

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-112552279-A Synthesis method of substituted dibenzothiophene compound 郑州海阔光电材料有限公司 2021-03-26 CN disclosed