SCHEMBL9632278

SCHEMBL9632278

CCOC(=O)C(C)(Cc1cccc(C)c1)C(=O)OCC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.58
PPARA Q07869 2/20 0.47
PPARG P37231 1/20 0.47
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 4/20 0.45
LMNA P02545 2/20 0.45
MAPT P10636 2/20 0.45
GPR119 Q8TDV5 1/20 0.44
RECQL P46063 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
MAOB P27338 2/20 0.41
TP53 P04637 1/20 0.41
IDO1 P14902 2/20 0.41
CTBP2 P56545 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 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
SCHEMBL19006263 0.88 MMP8 (0.48) MMP8PPARAPPARGKMT2AALDH1A1
SCHEMBL18473845 0.85 MMP8 (0.56) MMP8PPARAPPARGKMT2AALDH1A1
SCHEMBL8710582 0.83 MMP8 (0.79) MMP8ALDH1A1LMNAMAPTRECQL
SCHEMBL9087201 0.82 KDM4E (0.54) MMP8PPARAPPARGALDH1A1MAPT
SCHEMBL1204803 0.80 MAPT (0.53) MMP8KMT2AALDH1A1LMNAMAPT
SCHEMBL28737716 0.80 MMP8 (0.60) MMP8PPARAKMT2AALDH1A1LMNA
SCHEMBL7639432 0.79 MMP8 (0.56) MMP8PPARAPPARGALDH1A1RECQL
SCHEMBL28817686 0.78 MMP8 (0.66) MMP8PPARAPPARGALDH1A1LMNA
SCHEMBL17106362 0.76 MAOB (0.42) KMT2AALDH1A1LMNAMAPTHPGD
SCHEMBL9526598 0.76 MMP8 (0.73) MMP8ALDH1A1LMNAMAPTRECQL

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
EP-0343182-B1 ALCOHOLS WITH 3-METHYL OR 3,5-DIMETHYL GROUPS, THEIR PRODUCTION AND THEIR USE AS AROMATICS Consortium für elektrochemische Industrie GmbH (DE) 1992-05-06 EP disclosed
US-4968668-A Alcohols having 3-methyl or 3,5-dimethyl or 3,5-dimethylphenyl groups, a process for their preparation and a fragrance composition containing same CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 1990-11-06 US disclosed
EP-0343182-A1 ALCOHOLS WITH 3-METHYL OR 3,5-DIMETHYL GROUPS, THEIR PRODUCTION AND THEIR USE AS AROMATICS. CONSORTIUM ELEKTROCHEM IND (DE) 1989-11-29 EP disclosed
WO-1988005770-A1 ALCOHOLS WITH 3-METHYL OR 3,5-DIMETHYL GROUPS THEIR PRODUCTION AND THEIR USE AS AROMATICS Consortium für elektrochemische Industrie GmbH (DE) 1988-08-11 WO disclosed