SCHEMBL9355808

SCHEMBL9355808

CC(C)(C)OOC(C)(C)c1ccc(C(=O)c2ccc(Br)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
LMNA P02545 2/20 0.50
MAPK1 P28482 2/20 0.50
MEN1 O00255 2/20 0.50
MAPT P10636 1/20 0.50
RAB9A P51151 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
SRD5A2 P31213 2/20 0.43
ELANE P08246 2/20 0.40
CES2 O00748 1/20 0.39
CES1 P23141 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
OGG1 O15527 1/20 0.38
CYP1A2 P05177 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
AKR1C3 P42330 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37

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
SCHEMBL9351579 0.91 SRD5A2 (0.50) LMNAMAPK1MAPTRAB9ASRD5A2
SCHEMBL781927 0.85 MAPK1 (0.53) KMT2AMAPK1MEN1MAPTRAB9A
SCHEMBL9351571 0.83 ELANE (0.51) KMT2ALMNAMAPK1MEN1MAPT
SCHEMBL9351687 0.81 ELANE (0.41) KMT2ALMNAMAPK1MEN1SRD5A2
SCHEMBL9352510 0.79 MAPK1 (0.41) KMT2ALMNAMAPK1MEN1MAPT
SCHEMBL9351799 0.79 MAPK1 (0.65) KMT2AMAPK1MEN1RAB9ASRD5A2
SCHEMBL779449 0.79 MAPT (0.45) KMT2ALMNAMAPK1MEN1MAPT
SCHEMBL9351750 0.79 LMNA (0.39) KMT2ALMNAMAPK1MEN1RAB9A
SCHEMBL2685393 0.78 SRD5A2 (0.68) KMT2ALMNAMAPK1MEN1MAPT
SCHEMBL9352468 0.78 TDP1 (0.44) LMNAMAPK1MAPTRAB9ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0409520-B1 Novel dialkyl peroxides, production method and use thereof NIPPON OILS & FATS CO LTD (JP) 1994-09-14 EP disclosed
US-5091586-A Photolysis type or pyrolysis type forming agents NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1992-02-25 US disclosed
EP-0409520-A2 Novel dialkyl peroxides, production method and use thereof NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1991-01-23 EP disclosed