SCHEMBL22775313

SCHEMBL22775313

CCCC(C)C(=O)OOC(=O)CC(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
ALDH1A1 P00352 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 2/20 0.33
TSHR P16473 2/20 0.32
CHRM1 P11229 1/20 0.31
AKR1A1 P14550 1/20 0.31
CHRM3 P20309 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
ADRA1A P35348 1/20 0.31
HRH1 P35367 1/20 0.31
DRD3 P35462 1/20 0.31
SLC6A3 Q01959 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
SCHEMBL2914469 0.85 SMN1; SMN2 (0.41) ALDH1A1SMN1; SMN2MEN1KMT2ATDP1
SCHEMBL22775212 0.84 MMP1 (0.38) MMP1MMP2MMP3MMP9MMP13
SCHEMBL22774990 0.82 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2MEN1KMT2ATDP1
SCHEMBL22775283 0.79 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2MEN1KMT2ATDP1
SCHEMBL5424411 0.78 ALDH1A1 (0.50) MMP1MMP2MMP3MMP9MMP13
SCHEMBL22775480 0.78 BIRC2 (0.40) CA2
SCHEMBL22774007 0.77 MMP1 (0.42) MMP1MMP2MMP3MMP9MMP13
SCHEMBL22775370 0.77 LMNA (0.53) ALDH1A1MEN1KMT2ATDP1TSHR
SCHEMBL22774945 0.75 ALDH1A1 (0.48) MMP1MMP2MMP3MMP9MMP13
SCHEMBL3904364 0.75 TSHR (0.44) ALDH1A1SMN1; SMN2MEN1KMT2ATDP1

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
US-11976034-B2 Process for the production of diacyl peroxides NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2024-05-07 US disclosed
EP-3983370-B1 PROCESS FOR THE PRODUCTION OF DIACYL PEROXIDES NOURYON CHEMICALS INT BV (NL) 2023-08-02 EP disclosed
US-20220235003-A1 PROCESS FOR THE PRODUCTION OF DIACYL PEROXIDES NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2022-07-28 US disclosed
EP-3983370-A1 PROCESS FOR THE PRODUCTION OF DIACYL PEROXIDES Nouryon Chemicals International B.V. (NL) 2022-04-20 EP disclosed
WO-2020249691-A1 PROCESS FOR THE PRODUCTION OF DIACYL PEROXIDES NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2020-12-17 WO disclosed