SCHEMBL9404982

SCHEMBL9404982

C=CCc1ccc(OC(CO)c2ccccc2)c(OC)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
PPARA Q07869 3/20 0.58
PPARG P37231 1/20 0.58
PPARD Q03181 1/20 0.58
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
CYP3A4 P08684 2/20 0.57
TDP1 Q9NUW8 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.54
HTT P42858 2/20 0.54
MAPT P10636 2/20 0.54
KDM4E B2RXH2 1/20 0.54
LMNA P02545 1/20 0.54
GAA P10253 1/20 0.54
PTGS1 P23219 2/20 0.52
ALOX5 P09917 1/20 0.51
AR P10275 1/20 0.51
TRPM8 Q7Z2W7 1/20 0.51
NPC1 O15118 2/20 0.48

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
SCHEMBL3693447 0.80 ALDH1A1 (0.58) ALDH1A1PPARAPPARGPPARDMEN1
SCHEMBL28143547 0.79 ALDH1A1 (0.65) ALDH1A1PPARAPPARGPPARDMEN1
SCHEMBL2030040 0.77 ALDH1A1 (0.71) ALDH1A1PPARAPPARGPPARDMEN1
SCHEMBL441966 0.77 KMT2A (0.57) ALDH1A1PPARAPPARGPPARDMEN1
SCHEMBL21414823 0.77 ALDH1A1 (0.75) ALDH1A1PPARAPPARGPPARDMEN1
Methyleugenol SCHEMBL9745056 0.76 ALDH1A1 (0.86) ALDH1A1PPARAPPARGPPARDMEN1
SCHEMBL525885 0.76 GABRA1 (0.52) ALDH1A1PPARAPPARGPPARDMEN1
SCHEMBL1870530 0.76 ALDH1A1 (0.86) ALDH1A1PPARAPPARGPPARDMEN1
Methyleugenol SCHEMBL1869396 0.76 ALDH1A1 (1.00) ALDH1A1PPARAPPARGPPARDMEN1
Methyleugenol SCHEMBL29376951 0.76 ALDH1A1 (1.00) ALDH1A1PPARAPPARGPPARDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230172525-A1 COMPOSITIONS AND METHODS FOR A UNIVERSAL CLINICAL TEST FOR OLFACTORY DYSFUNCTION THE ROCKEFELLER UNIVERSITY 2023-06-08 US claimed
EP-3648613-A1 COMPOSITIONS AND METHODS FOR A UNIVERSAL CLINICAL TEST FOR OLFACTORY DYSFUNCTION The Rockefeller University (US) 2020-05-13 EP claimed
WO-2019010172-A1 COMPOSITIONS AND METHODS FOR A UNIVERSAL CLINICAL TEST FOR OLFACTORY DYSFUNCTION THE ROCKEFELLER UNIVERSITY (US) 2019-01-10 WO claimed
JP-6199690-A None JP disclosed
US-20230172525-A1 COMPOSITIONS AND METHODS FOR A UNIVERSAL CLINICAL TEST FOR OLFACTORY DYSFUNCTION THE ROCKEFELLER UNIVERSITY 2023-06-08 US disclosed
EP-3648613-A1 COMPOSITIONS AND METHODS FOR A UNIVERSAL CLINICAL TEST FOR OLFACTORY DYSFUNCTION The Rockefeller University (US) 2020-05-13 EP disclosed
WO-2019010172-A1 COMPOSITIONS AND METHODS FOR A UNIVERSAL CLINICAL TEST FOR OLFACTORY DYSFUNCTION THE ROCKEFELLER UNIVERSITY (US) 2019-01-10 WO disclosed
JP-H06199690-A AGENT FOR PROMOTING CEREBRAL METABOLISM AND IMPROVING CEREBRAL FUNCTION YUNIE:KK 1994-07-19 JP disclosed