SCHEMBL4648032

SCHEMBL4648032

CCCCCCCC(C)c1ccccc1OCC1CO1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
GLA P06280 1/20 0.51
HRH3 Q9Y5N1 3/20 0.44
TDP1 Q9NUW8 2/20 0.41
PPARG P37231 2/20 0.40
ADRB2 P07550 1/20 0.40
HTR1A P08908 1/20 0.40
SLC6A2 P23975 1/20 0.40
HTR2A P28223 1/20 0.40
SLC6A4 P31645 1/20 0.40
ADRA1A P35348 1/20 0.40
HTR2B P41595 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
TSHR P16473 1/20 0.37
HIF1A Q16665 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
SCHEMBL16828346 0.84 ALDH1A1 (0.43) ALDH1A1GLAHRH3TDP1PPARG
SCHEMBL283872 0.84 ALDH1A1 (0.59) ALDH1A1GLAHRH3TDP1ADRB2
SCHEMBL30184861 0.84 ALDH1A1 (0.59) ALDH1A1GLAHRH3TDP1ADRB2
Methane SCHEMBL11498549 0.82 ALDH1A1 (0.58) ALDH1A1GLAHRH3TDP1ADRB2
SCHEMBL14280091 0.81 PPARG (0.50) ALDH1A1PPARGHTR2BSLC6A3KDM4E
SCHEMBL8735083 0.79 ALDH1A1 (0.65) ALDH1A1GLAHRH3TDP1PPARG
SCHEMBL4897371 0.79 ALDH1A1 (0.65) ALDH1A1GLAHRH3TDP1PPARG
SCHEMBL6679792 0.77 PPARG (0.46) ALDH1A1PPARGHTR1ATSHRMEN1
SCHEMBL13864552 0.77 PPARG (0.46) ALDH1A1PPARGHTR1ATSHRMEN1
SCHEMBL9682439 0.76 ALDH1A1 (0.57) ALDH1A1GLAHRH3TDP1PPARG

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-1900024-A2 B-STAGEABLE FILM, ELECTRONIC DEVICE, AND ASSOCIATED PROCESS Momentive Performance Materials Inc. (US) 2008-03-19 EP disclosed
WO-2006135556-A2 B-STAGEABLE FILM, ELECTRONIC DEVICE, AND ASSOCIATED PROCESS MOMENTIVE PERFORMANCE MATERIALS INC. (US) 2006-12-21 WO disclosed
US-20060275608-A1 B-stageable film, electronic device, and associated process GENERAL ELECTRIC COMPANY 2006-12-07 US disclosed