SCHEMBL30397694

SCHEMBL30397694

CCCC(C)C1CCC2=C(C1)C(=O)c1ccccc1C2=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.34
ALDH1A1 P00352 6/20 0.34
MAPT P10636 6/20 0.34
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
DHODH Q02127 1/20 0.33
AKT1 P31749 3/20 0.33
PKM P14618 3/20 0.33
TP53 P04637 2/20 0.33
MAPK10 P53779 2/20 0.33
IDO1 P14902 1/20 0.33
PTPN1 P18031 2/20 0.32
SLC25A5 P05141 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
MITF O75030 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL2492418 1.00 SMN1; SMN2 (0.34) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL2490945 0.88 MAPT (0.36) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL2491377 0.82 IDO1 (0.37) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL7048891 0.79 IDO1 (0.36) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL28281311 0.75 AKT1 (0.40) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL30393799 0.74 LMNA (0.39) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL183347 0.74 LMNA (0.39) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
Anthraquinone SCHEMBL28278072 0.73 LMNA (0.41) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL11878454 0.72 CYP1A2 (0.39) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL9004509 0.72 AKT1 (0.34) SMN1; SMN2ALDH1A1MAPTAKT1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118604219-A Mobile phase compound system for liquid chromatography and liquid chromatography analysis method for preparing hydrogen peroxide high-yield working solution by anthraquinone method 黎明化工研究设计院有限责任公司 2024-09-06 CN disclosed
CN-118604219-A Mobile phase compound system for liquid chromatography and liquid chromatography analysis method for preparing hydrogen peroxide high-yield working solution by anthraquinone method 黎明化工研究设计院有限责任公司 2024-09-06 CN disclosed
CN-117509553-A Working solution for producing hydrogen peroxide by anthraquinone process and production method of hydrogen peroxide 中国石油化工股份有限公司 2024-02-06 CN disclosed
CN-116062701-A Single-solvent working fluid system and production method of anthraquinone-process hydrogen peroxide 中国石油化工股份有限公司 2023-05-05 CN disclosed