SCHEMBL28698501

SCHEMBL28698501

O=C(c1ccccc1)N(C(=O)c1ccccc1)c1ccccc1-c1ccccc1.O=C(c1ccccc1)N(C(=O)c1ccccc1)c1ccccc1-c1ccccc1.SS

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
BCAT2 O15382 1/20 0.40
ALDH1A1 P00352 5/20 0.40
HPGD P15428 2/20 0.40
MAPT P10636 1/20 0.40
LTB4R2 Q9NPC1 1/20 0.39
FOLH1 Q04609 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA3 P07451 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 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
SCHEMBL7200742 0.98 MEN1 (0.46) MEN1KMT2ASMN1; SMN2L3MBTL1TDP1
SCHEMBL23374991 0.80 KMT2A (0.46) MEN1KMT2ASMN1; SMN2BCAT2ALDH1A1
SCHEMBL27742739 0.77 GAA (0.53) MEN1KMT2ASMN1; SMN2BCAT2ALDH1A1
SCHEMBL31122687 0.74 ALDH1A1 (0.47) MEN1KMT2ASMN1; SMN2L3MBTL1BCAT2
SCHEMBL3783945 0.74 ALDH1A1 (0.37) MEN1KMT2ASMN1; SMN2L3MBTL1TDP1
SCHEMBL8931070 0.73 ALDH1A1 (0.60) MEN1KMT2AL3MBTL1TDP1ALDH1A1
SCHEMBL10538919 0.71 GAA (0.50) SMN1; SMN2L3MBTL1TDP1ALDH1A1HPGD
SCHEMBL7409011 0.70 KMT2A (0.45) MEN1KMT2ASMN1; SMN2ALDH1A1HPGD
SCHEMBL27637324 0.69 BCAT2 (0.47) MEN1KMT2ASMN1; SMN2BCAT2ALDH1A1
SCHEMBL5883327 0.69 TACR1 (0.54) MEN1KMT2ASMN1; SMN2BCAT2ALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114031811-A Method for desulfurizing waste tires by using supercritical carbon dioxide 北京工业大学 2022-02-11 CN claimed
CN-117897281-A Anti-aging light-permeable composite material for vehicle tires and production method thereof 大陆轮胎德国有限公司 2024-04-16 CN disclosed
CN-117897271-A Composite material for vehicle tires and method for producing the same 大陆轮胎德国有限公司 2024-04-16 CN disclosed
CN-117897269-A Composite material for protecting vehicle tyre from abrasion and production method thereof 大陆轮胎德国有限公司 2024-04-16 CN disclosed
CN-115215737-B Method for preparing aldehyde or ketone by alcohol selective oxidation 嘉兴学院 2023-06-27 CN disclosed