SCHEMBL11209349

SCHEMBL11209349

CCCCCC(CC)(Oc1ccccc1)C(=O)Cl

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
PPARG P37231 4/20 0.39
PPARA Q07869 4/20 0.39
PPARD Q03181 2/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.37
LTA4H P09960 1/20 0.37
FAAH O00519 6/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36

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
SCHEMBL28212657 0.88 GAA (0.44) GAAPPARGPPARAPPARDZDHHC2
SCHEMBL28148535 0.83 PPARG (0.48) GAAPPARGPPARAPPARDZDHHC2
Ammonia Solution, Strong SCHEMBL28523622 0.82 PPARG (0.47) GAAPPARGPPARAPPARDZDHHC2
SCHEMBL11767154 0.82 PPARG (0.47) GAAPPARGPPARAPPARDZDHHC2
SCHEMBL15902943 0.81 PPARG (0.46) GAAPPARGPPARAPPARDZDHHC2
SCHEMBL2238586 0.80 PPARA (0.52) PPARGPPARAPPARDFAAHCYP3A4
SCHEMBL27778224 0.78 PPARA (0.44) PPARGPPARAPPARDCYP3A4TSHR
SCHEMBL29014003 0.77 TSHR (0.50) PPARGFAAHTP53CYP3A4TSHR
SCHEMBL28159770 0.77 PPARG (0.43) PPARGPPARAPPARDLTA4HCYP3A4
SCHEMBL23754112 0.76 PPARG (0.45) PPARGPPARAPPARDCYP3A4

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
EP-0087388-A1 Pyrazolone couplers and colour photographic silver halide recording material containing them CIBA-GEIGY AG (CH) 1983-08-31 EP disclosed