SCHEMBL10722909

SCHEMBL10722909

CCCC(Oc1ccc2ccccc2c1)C(=O)OCC

nearest known ligand 0.74

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.74
PPARA Q07869 4/20 0.74
GAA P10253 1/20 0.45
PTGS2 P35354 1/20 0.44
CETP P11597 1/20 0.44
POLB P06746 1/20 0.43
RAB9A P51151 1/20 0.43
PTPN7 P35236 1/20 0.43
AR P10275 1/20 0.42
RECQL P46063 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
PPARD Q03181 1/20 0.41
ALDH2 P05091 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
SCHEMBL27709801 0.89 PPARG (0.59) PPARGPPARAGAAPTGS2CETP
SCHEMBL10727383 0.89 PPARG (0.59) PPARGPPARAGAAPTGS2CETP
SCHEMBL27504808 0.84 PPARG (0.55) PPARGPPARAPOLBTDP1
SCHEMBL2074029 0.84 PPARG (0.53) PPARGPPARAARALDH2
SCHEMBL10722343 0.84 PPARG (0.76) PPARGPPARACETPRAB9APTPN7
SCHEMBL9451277 0.81 PPARG (0.59) PPARGPPARAGAAPTGS2CETP
SCHEMBL10722124 0.81 PPARG (0.72) PPARGPPARACETPRAB9APTPN7
SCHEMBL3993398 0.80 LMNA (0.61) PPARGPPARAGAAPTGS2POLB
SCHEMBL28608607 0.80 PPARG (0.48) PPARGPPARAGAAPOLBRAB9A
SCHEMBL25462871 0.79 PPARG (0.52) PPARGPPARAGAAPTGS2CETP

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-4670469-A ANTIASTHMATIC AGENTS; CARDIOVASCULAR DISORDERS VEB ARZNEIMITTELWERK DRESDEN (DD) 1987-06-02 US disclosed