SCHEMBL6708124

SCHEMBL6708124

C=CC(=O)OC(C)(OC(=O)C=C)Oc1ccc(C(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
RAB9A P51151 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
PPARA Q07869 2/20 0.38
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C9 P11712 1/20 0.36
HIF1A Q16665 1/20 0.36
THRB P10828 1/20 0.36
RXRA P19793 1/20 0.35
RXRB P28702 1/20 0.35
ACACB O00763 1/20 0.35
FKBP1A P62942 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL5344254 0.81 PPARA (0.51) ALDH1A1MEN1KMT2APPARAPPARG
SCHEMBL4596363 0.79 THRB (0.54) ALDH1A1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL28450603 0.78 THRB (0.46) ALDH1A1RAB9AMEN1KMT2APPARA
SCHEMBL9819157 0.76 CYP2C9 (0.38) ALDH1A1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL4651432 0.72 THRB (0.39) ALDH1A1MEN1KMT2APPARAPPARG
SCHEMBL8844438 0.72 RAB9A (0.40) ALDH1A1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL9819162 0.71 THRB (0.39) ALDH1A1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL31474462 0.71 SMN1; SMN2 (0.39) ALDH1A1RAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL18372610 0.71 ACACB (0.42) MEN1KMT2APPARAPPARGSMN1; SMN2
SCHEMBL2768277 0.71 THRB (0.43) ALDH1A1RAB9AKMT2APPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040042379-A1 Optical storage medium 3M INNOVATIVE PROPERTIES COMPANY 2004-03-04 US disclosed
EP-1330822-A2 OPTICAL STORAGE MEDIUM 3M Innovative Properties Company (US) 2003-07-30 EP disclosed
EP-1173795-B1 OPTICAL STORAGE MEDIUM 3M INNOVATIVE PROPERTIES CO (US) 2003-07-02 EP disclosed
WO-2003049100-A1 METHOD FOR PREPARING AN OPTICAL STORAGE MEDIUM 3M INNOVATIVE PROPERTIES COMPANY (US) 2003-06-12 WO disclosed
EP-1316952-A1 Method for preparing an optical storage medium 3M Innovative Properties Company (US) 2003-06-04 EP disclosed
EP-1204108-A2 Optical storage medium and method of manufacture 3M Innovative Properties Company (US) 2002-05-08 EP disclosed
WO-2002035525-A2 OPTICAL STORAGE MEDIUM 3M INNOVATIVE PROPERTIES COMPANY (US) 2002-05-02 WO disclosed
EP-1202262-A1 Optical storage medium 3M Innovative Properties Company (US) 2002-05-02 EP disclosed
EP-1173795-A1 OPTICAL STORAGE MEDIUM 3M Innovative Properties Company (US) 2002-01-23 EP disclosed
WO-2000065409-A2 OPTICAL STORAGE MEDIUM 3M INNOVATIVE PROPERTIES COMPANY (US) 2000-11-02 WO disclosed