SCHEMBL29155697

SCHEMBL29155697

CCOC(=O)C1=C(C)NC(S)NC1c1cccc(O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.66
POLB P06746 1/20 0.61
SMN1; SMN2 Q16637 3/20 0.47
NPSR1 Q6W5P4 1/20 0.47
DHFR P00374 2/20 0.46
ALDH1A1 P00352 5/20 0.45
MAPK1 P28482 2/20 0.45
ALOX15 P16050 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GUSB P08236 1/20 0.44
TSHR P16473 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALOX12 P18054 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
LMNA P02545 2/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL28043871 0.83 KIF11 (0.62) KIF11POLBSMN1; SMN2NPSR1DHFR
SCHEMBL5341216 0.80 KIF11 (1.00) KIF11POLBSMN1; SMN2NPSR1ALDH1A1
SCHEMBL17323002 0.79 KIF11 (0.77) KIF11POLBSMN1; SMN2NPSR1DHFR
S-Menastrol SCHEMBL74457 0.79 KIF11 (0.77) KIF11POLBDHFRALDH1A1GUSB
Monastrol SCHEMBL3168349 0.79 KIF11 (0.77) KIF11POLBDHFRALDH1A1GUSB
SCHEMBL28577481 0.77 KIF11 (0.73) KIF11POLBSMN1; SMN2NPSR1DHFR
SCHEMBL11785984 0.75 KDM4E (0.70) KIF11POLBSMN1; SMN2ALDH1A1MAPK1
SCHEMBL14164071 0.74 POLB (0.79) KIF11POLBSMN1; SMN2ALDH1A1MAPK1
SCHEMBL28881024 0.71 KIF11 (0.48) KIF11POLBSMN1; SMN2DHFRALDH1A1
SCHEMBL3341613 0.71 KIF11 (0.62) KIF11POLBSMN1; SMN2DHFRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117304573-B High-temperature-resistant and wear-resistant auxiliary agent for rubber and preparation method thereof 科迈特新材料有限公司 2024-05-31 CN claimed
CN-117304573-A High-temperature-resistant and wear-resistant auxiliary agent for rubber and preparation method thereof 科迈特新材料有限公司 2023-12-29 CN claimed
CN-117304573-B High-temperature-resistant and wear-resistant auxiliary agent for rubber and preparation method thereof 科迈特新材料有限公司 2024-05-31 CN disclosed
CN-117304573-B High-temperature-resistant and wear-resistant auxiliary agent for rubber and preparation method thereof 科迈特新材料有限公司 2024-05-31 CN disclosed
CN-117817924-B High-temperature-resistant multilayer co-extrusion film, preparation process and application thereof in aerospace 安徽紫金新材料科技股份有限公司 2024-05-24 CN disclosed
CN-117817924-A High-temperature-resistant multilayer co-extrusion film, preparation process and application thereof in aerospace 安徽紫金新材料科技股份有限公司 2024-04-05 CN disclosed
CN-117304573-A High-temperature-resistant and wear-resistant auxiliary agent for rubber and preparation method thereof 科迈特新材料有限公司 2023-12-29 CN disclosed
CN-117304573-A High-temperature-resistant and wear-resistant auxiliary agent for rubber and preparation method thereof 科迈特新材料有限公司 2023-12-29 CN disclosed