SCHEMBL11021167

SCHEMBL11021167

CCC(C)(C)C1CCC(OC(=O)OOC(=O)OC2CCC(C(C)(C)CC)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 2/20 0.37
KDM4E B2RXH2 2/20 0.37
CYP19A1 P11511 1/20 0.36
MAPT P10636 4/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
S1PR5 Q9H228 1/20 0.34
GAA P10253 4/20 0.33
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
EPHX1 P07099 1/20 0.33
LMNA P02545 1/20 0.31
NAAA Q02083 2/20 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
SCHEMBL27446066 0.87 APOBEC3A (0.39) APOBEC3AAPOBEC3GSMN1; SMN2HTTKDM4E
SCHEMBL13433863 0.85 APOBEC3A (0.35) APOBEC3AAPOBEC3GSMN1; SMN2HTTKDM4E
SCHEMBL113594 0.84 APOBEC3A (0.39) APOBEC3AAPOBEC3GSMN1; SMN2HTTKDM4E
SCHEMBL13801000 0.83 APOBEC3A (0.35) APOBEC3AAPOBEC3GSMN1; SMN2HTTKDM4E
SCHEMBL13353941 0.82 APOBEC3A (0.34) APOBEC3AAPOBEC3GSMN1; SMN2HTTKDM4E
SCHEMBL13353986 0.81 APOBEC3A (0.33) APOBEC3AAPOBEC3GSMN1; SMN2HTTKDM4E
SCHEMBL13433935 0.81 APOBEC3A (0.33) APOBEC3AAPOBEC3GSMN1; SMN2HTTKDM4E
SCHEMBL35809 0.81 MAPT (0.50) APOBEC3AAPOBEC3GSMN1; SMN2HTTKDM4E
SCHEMBL31190347 0.81 APOBEC3A (0.37) APOBEC3AAPOBEC3GSMN1; SMN2HTTKDM4E
SCHEMBL13433864 0.80 APOBEC3A (0.33) APOBEC3AAPOBEC3GSMN1; SMN2HTTKDM4E

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
EP-0056378-B1 AQEOUS SUSPENSIONS OF ORGANIC PEROXIDES INTEROX CHEMICALS PTY. LIMITED (AU) 1985-05-29 EP claimed
EP-0056378-B1 AQEOUS SUSPENSIONS OF ORGANIC PEROXIDES INTEROX CHEMICALS PTY. LIMITED (AU) 1985-05-29 EP disclosed
EP-0056378-A4 AQEOUS SUSPENSIONS OF ORGANIC PEROXIDES. INTEROX CHEMICALS LTD (AU) 1982-11-08 EP disclosed
EP-0056378-A1 AQEOUS SUSPENSIONS OF ORGANIC PEROXIDES. INTEROX CHEMICALS LTD (AU) 1982-07-28 EP disclosed
WO-1982000104-A1 AQUEOUS SUSPENSIONS OF ORGANIC PEROXIDES LAAR H 1982-01-21 WO disclosed