SCHEMBL5590799

SCHEMBL5590799

COc1ccc(C(=O)O)cc1CC=C(C)CCC=C(C)C.[NaH]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.56
PPARG P37231 2/20 0.51
PPARD Q03181 1/20 0.51
PPARA Q07869 1/20 0.51
DNMT1 P26358 1/20 0.51
SIRT5 Q9NXA8 1/20 0.51
MTNR1A P48039 1/20 0.48
PTPN1 P18031 2/20 0.47
PTGES O14684 2/20 0.46
TSHR P16473 2/20 0.46
ACHE P22303 2/20 0.46
BCHE P06276 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA7 P43166 1/20 0.46
TPMT P51580 1/20 0.46
CA9 Q16790 1/20 0.46

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
SCHEMBL12702676 0.88 BACE1 (0.56) BACE1PPARGPPARDPPARADNMT1
SCHEMBL8009534 0.87 BACE1 (0.53) BACE1PPARGPPARDPPARADNMT1
SCHEMBL8019435 0.87 BACE1 (0.58) BACE1PPARGPPARDPPARADNMT1
SCHEMBL5590795 0.87 PPARG (0.45) BACE1PPARGPPARDPPARADNMT1
SCHEMBL27639564 0.87 PPARG (0.45) BACE1PPARGPPARDPPARADNMT1
SCHEMBL5590796 0.87 PPARG (0.45) BACE1PPARGPPARDPPARADNMT1
SCHEMBL8011278 0.86 BACE1 (0.55) BACE1PPARGPPARDPPARADNMT1
SCHEMBL27660340 0.86 PTGES (0.46) BACE1PPARGPPARDPPARADNMT1
SCHEMBL8023186 0.84 BACE1 (0.52) BACE1TSHRACHE
SCHEMBL16224898 0.83 PPARG (0.53) BACE1PPARGPPARDPPARADNMT1

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
JP-2007204431-A FAT CELL DIFFERENTIATION PROMOTER FUJI SANGYO KK 2007-08-16 JP disclosed