SCHEMBL9724372

SCHEMBL9724372

CC=CC=CC=CC(C)=O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
CNR2 P34972 9/20 0.41
CNR1 P21554 7/20 0.41
PPARG P37231 2/20 0.38
PPARD Q03181 2/20 0.38
PPARA Q07869 2/20 0.38
TRPA1 O75762 2/20 0.36
TRPV1 Q8NER1 1/20 0.36
MAPK1 P28482 1/20 0.33
SOAT1 P35610 1/20 0.33
TSHR P16473 1/20 0.33
THPO P40225 1/20 0.33
RAB9A P51151 1/20 0.32
GLA P06280 1/20 0.31
TDP1 Q9NUW8 1/20 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
SCHEMBL13604717 1.00 ALDH1A1 (0.43) ALDH1A1CNR2CNR1PPARGPPARD
SCHEMBL13604747 1.00 ALDH1A1 (0.43) ALDH1A1CNR2CNR1PPARGPPARD
SCHEMBL14432216 1.00 ALDH1A1 (0.43) ALDH1A1CNR2CNR1PPARGPPARD
SCHEMBL2632246 1.00 ALDH1A1 (0.43) ALDH1A1CNR2CNR1PPARGPPARD
SCHEMBL16063270 0.97
SCHEMBL3132514 0.97
SCHEMBL16917646 0.97
SCHEMBL3132513 0.97
Carbon Monoxide SCHEMBL7018930 0.89 CNR2 (0.36) ALDH1A1CNR2CNR1PPARGPPARD
SCHEMBL821048 0.84 TSHR (0.46) ALDH1A1TSHRTHPOGLATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4221352-A None JP disclosed
US-11062794-B2 Olfactory signature and odorant mixture having the same YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2021-07-13 US disclosed
US-20180253534-A1 OLFACTORY SIGNATURE AND ODORANT MIXTURE HAVING THE SAME YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2018-09-06 US disclosed
US-9959392-B2 Olfactory signature and odorant mixture having the same YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2018-05-01 US disclosed
US-20140221269-A1 OLFACTORY SIGNATURE AND ODORANT MIXTURE HAVING THE SAME YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2014-08-07 US disclosed
WO-2013035070-A1 OLFACTORY SIGNATURE AND ODORANT MIXTURE HAVING THE SAME YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2013-03-14 WO disclosed
JP-H04221352-A PROPANOBICYCLIC AMINE DERIVATIVE FOR CNS DISORDER G D SEARLE & CO 1992-08-11 JP disclosed