SCHEMBL16743963

SCHEMBL16743963

COC(Cc1ccc(O)cc1)C(C)=O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.56
ESR2 Q92731 4/20 0.56
SLC7A5 Q01650 1/20 0.50
TAAR1 Q96RJ0 3/20 0.46
SLC6A2 P23975 1/20 0.46
MIF P14174 1/20 0.44
PPARG P37231 2/20 0.42
PPARD Q03181 2/20 0.42
PPARA Q07869 2/20 0.42
HDAC8 Q9BY41 1/20 0.41
KDM4E B2RXH2 1/20 0.41
F13A1 P00488 1/20 0.41
LDHA P00338 1/20 0.41

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
SCHEMBL4941128 0.85 PPARA (0.56) ESR1ESR2SLC7A5PPARGPPARD
SCHEMBL4451311 0.85 PPARA (0.56) ESR1ESR2SLC7A5PPARGPPARD
SCHEMBL3466702 0.85 PPARA (0.56) ESR1ESR2SLC7A5PPARGPPARD
SCHEMBL14560811 0.84 PPARA (0.67) ESR1ESR2PPARGPPARDPPARA
SCHEMBL5606989 0.84 PPARA (0.55) ESR1ESR2SLC7A5PPARGPPARD
SCHEMBL5607756 0.84 PPARA (0.55) ESR1ESR2SLC7A5PPARGPPARD
SCHEMBL5607096 0.84 PPARA (0.55) ESR1ESR2SLC7A5PPARGPPARD
SCHEMBL5606722 0.84 PPARA (0.55) ESR1ESR2SLC7A5PPARGPPARD
SCHEMBL4811729 0.84 PPARA (0.55) ESR1ESR2SLC7A5PPARGPPARD
Ammonia Solution, Strong SCHEMBL5606748 0.84 PPARA (0.55) ESR1ESR2SLC7A5PPARGPPARD

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
US-9040531-B2 Alpha helix mimetics and methods relating thereto Prism BioLab Co., Ltd. (JP) 2015-05-26 US disclosed