SCHEMBL9734501

SCHEMBL9734501

CCOC(=O)C1Cc2ccc(O)cc2OC1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
KMT2A Q03164 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PPARG P37231 11/20 0.44
PPARA Q07869 10/20 0.42
CCNE1 P24864 1/20 0.39
CDK2 P24941 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
KLK5 Q9Y337 1/20 0.38
KIF11 P52732 1/20 0.38
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA7 P43166 2/20 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
SCHEMBL5116383 0.85 PPARG (0.48) MEN1ALDH1A1KMT2APPARGPPARA
SCHEMBL28999667 0.85 PPARG (0.54) KDM4EMEN1ALDH1A1GAAMAPT
SCHEMBL13520076 0.83 PPARG (0.60) KDM4EMEN1ALDH1A1GAAMAPT
SCHEMBL9968951 0.80 HSD17B1 (0.45) KDM4EMEN1ALDH1A1GAAMAPT
SCHEMBL14038361 0.79 ESR2 (0.41) KDM4EMEN1ALDH1A1GAAMAPT
SCHEMBL31562259 0.77 CYP4F2 (0.49) KDM4EMEN1ALDH1A1GAAMAPT
SCHEMBL10635452 0.75 ESR1 (0.48) KDM4EMEN1ALDH1A1GAAMAPT
SCHEMBL8036388 0.75 KMT2A (0.74) KDM4EMEN1ALDH1A1GAAMAPT
SCHEMBL17049187 0.74 KDM4E (0.50) KDM4EMEN1ALDH1A1GAAMAPT
SCHEMBL14378544 0.73 FFAR1 (0.45) KDM4EALDH1A1HPGDKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5081044-A Detection of hydrogen peroxide with optical indicator chalcogen compounds MILES INC. (US) 1992-01-14 US disclosed
US-4996332-A On oxidation produce fluorescent signals in analytical systems MILES INC. (US) 1991-02-26 US disclosed
US-4778893-A FLUORESCENT; OXIDATION OF CHALCOGENS WITH HYDROGEN PEROXIDE MILES INC. (US) 1988-10-18 US disclosed
EP-0121743-B1 OPTICAL INDICATOR CHALCOGEN COMPOUNDS AND USE MILES LABORATORIES, INC. (US) 1987-09-09 EP disclosed
EP-0121743-A2 Optical indicator chalcogen compounds and use MILES LABORATORIES, INC. (US) 1984-10-17 EP disclosed