SCHEMBL6940931

SCHEMBL6940931

CSCOc1cc(CCCCCC[C@H](C(=O)O)C(C)C)ccc1C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.35
PPARG P37231 3/20 0.34
PPARA Q07869 2/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
RXRG P48443 1/20 0.34
REN P00797 10/20 0.34
PTGES O14684 1/20 0.34
ALOX5 P09917 1/20 0.34
TRPV1 Q8NER1 1/20 0.34
EPHX2 P34913 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
PLA2G4A P47712 1/20 0.32

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
SCHEMBL6940935 1.00 MRGPRX4 (0.35) MRGPRX4PPARGPPARARXRARXRB
SCHEMBL6938930 0.84 REN (0.45) MRGPRX4PPARGPPARARXRARXRB
SCHEMBL6947793 0.84 REN (0.45) MRGPRX4PPARGPPARARXRARXRB
SCHEMBL6947788 0.84 REN (0.45) MRGPRX4PPARGPPARARXRARXRB
SCHEMBL6938924 0.84 REN (0.45) MRGPRX4PPARGPPARARXRARXRB
SCHEMBL6948152 0.83 PPARA (0.43) MRGPRX4PPARGPPARARENPTGES
SCHEMBL6948146 0.83 PPARA (0.43) MRGPRX4PPARGPPARARENPTGES
SCHEMBL6948398 0.82 REN (0.36) MRGPRX4PPARGPPARARXRARXRB
SCHEMBL6948396 0.82 REN (0.36) MRGPRX4PPARGPPARARXRARXRB
SCHEMBL6942881 0.80 PPARA (0.42) PPARARENTRPV1GRIN2DGRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003103653-A1 METHODS OF TREATING ALZHEIMER'S DISEASE USING ARYL ALKANOIC ACID AMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed