SCHEMBL6949104

SCHEMBL6949104

CC(C)[C@@H](CCO)c1ccc(C(C)(C)C)c(OCc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.47
MRGPRX4 Q96LA9 1/20 0.44
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
RRM1 P23921 1/20 0.37
ALOX5 P09917 1/20 0.36
PRKCA P17252 1/20 0.36
PRKCD Q05655 1/20 0.36
CCR5 P51681 1/20 0.36
LIPE Q05469 1/20 0.36
F9 P00740 1/20 0.36
F10 P00742 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 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
SCHEMBL6940750 1.00 ALOX5AP (0.47) ALOX5APMRGPRX4RXRARXRBRXRG
SCHEMBL6943581 0.78 REN (0.47) RRM1F10TDP1
SCHEMBL6943335 0.76 CYP4F2 (0.55) RRM1ALOX5LMNAMAPK1
SCHEMBL4642584 0.75 ALOX5AP (0.55) ALOX5APMRGPRX4RXRARXRBRXRG
SCHEMBL6940748 0.75 ALOX5AP (0.48) ALOX5APMRGPRX4RXRARXRBRXRG
SCHEMBL6949100 0.75 ALOX5AP (0.48) ALOX5APMRGPRX4RXRARXRBRXRG
SCHEMBL6044614 0.75 ALOX5AP (0.48) ALOX5APMRGPRX4RXRARXRBRXRG
SCHEMBL6044462 0.75 ALOX5AP (0.48) ALOX5APMRGPRX4RXRARXRBRXRG
SCHEMBL6044456 0.75 ALOX5AP (0.48) ALOX5APMRGPRX4RXRARXRBRXRG
SCHEMBL6943816 0.74 KDM4E (0.38) LMNAMAPTTDP1NFE2L2

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