SCHEMBL2175392

SCHEMBL2175392

CCCOC(Cc1ccc(Br)cc1)C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
TDP1 Q9NUW8 1/20 0.45
PPARG P37231 5/20 0.42
PPARA Q07869 5/20 0.42
KDM4E B2RXH2 1/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PPARD Q03181 3/20 0.41
KMT2A Q03164 1/20 0.40
POLB P06746 2/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
LMNA P02545 1/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
ACACB O00763 1/20 0.39
MAPT P10636 1/20 0.38

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
SCHEMBL2175381 1.00 HDAC1 (0.46) HDAC1HDAC6TDP1PPARGPPARA
SCHEMBL1750768 0.88 PPARA (0.51) HDAC1HDAC6TDP1PPARGPPARA
SCHEMBL1750767 0.88 PPARA (0.51) HDAC1HDAC6TDP1PPARGPPARA
SCHEMBL7815559 0.87 ESR1 (0.55) TDP1PPARAKMT2AESR1ESR2
SCHEMBL3155465 0.85 PPARA (0.54) PPARGPPARAPPARD
SCHEMBL3155456 0.85 PPARA (0.54) PPARGPPARAPPARD
SCHEMBL2173501 0.82 HDAC1 (0.43) HDAC1HDAC6TDP1PPARGPPARA
SCHEMBL2173508 0.82 HDAC1 (0.43) HDAC1HDAC6TDP1PPARGPPARA
SCHEMBL15446290 0.80 HDAC1 (0.49) HDAC1HDAC6TDP1PPARGPPARA
SCHEMBL2175262 0.80 PSMB5 (0.48) HDAC1HDAC6PPARGPPARAPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7973063-B2 Methods for activating PPAR gamma-type receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-07-05 US disclosed
CN-1950335-A Novel biaromatic compounds which activate PPAR.gamma.-type receptors, their process of preparation and their use in cosmetic or pharmaceutical compositions GALDERMA RES & DEV (FR) 2007-04-18 CN disclosed