SCHEMBL28651007

SCHEMBL28651007

N#CCCS(=O)(=O)c1ccccc1.[SiH4]

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.54
MAPT P10636 3/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PSIP1 O75475 1/20 0.48
HSD11B1 P28845 4/20 0.46
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
NLRP3 Q96P20 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40

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
SCHEMBL6544699 0.98 TP53 (0.56) TP53MAPTALDH1A1LMNAHPGD
Dapansutrile SCHEMBL11291946 0.89 NLRP3 (0.59) TP53MAPTALDH1A1LMNAHPGD
SCHEMBL30859617 0.83 KEAP1 (0.53) TP53MAPTALDH1A1LMNAHPGD
SCHEMBL1785000 0.79 PSIP1 (0.52) MAPTPSIP1HSD11B1KEAP1NFE2L2
SCHEMBL10942217 0.78 TP53 (0.57) TP53MAPTALDH1A1LMNAHPGD
SCHEMBL10942620 0.78 TP53 (0.57) TP53MAPTALDH1A1LMNAHPGD
SCHEMBL16591747 0.78 ALDH1A1 (0.62) TP53MAPTALDH1A1LMNAHPGD
SCHEMBL16591746 0.78 TP53 (0.57) TP53MAPTALDH1A1LMNAHTT
SCHEMBL3167183 0.78 TP53 (0.57) TP53ALDH1A1LMNAHSD11B1L3MBTL1
SCHEMBL777601 0.78 PSIP1 (0.67) MAPTALDH1A1HSD17B10PSIP1HSD11B1

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-113667362-B High-temperature-resistant stainless steel seamless steel tube and surface treatment process thereof 浙江东方齐心钢业集团有限公司 2022-04-12 CN disclosed
CN-113667362-A High-temperature-resistant stainless steel seamless steel tube and surface treatment process thereof 浙江东方齐心钢业集团有限公司 2021-11-19 CN disclosed