SCHEMBL6661042

SCHEMBL6661042

CCOOP(=O)(O)CC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
BLM P54132 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PPARD Q03181 1/20 0.34
FFAR3 O14843 1/20 0.32
GAA P10253 1/20 0.31

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
SCHEMBL4835947 0.80 TSHR (0.39) MEN1LMNAHPGDTSHRBLM
SCHEMBL9081757 0.77 LMNA (0.46) MEN1LMNAHPGDTSHRBLM
SCHEMBL7597273 0.77 PPARD (0.52) MEN1LMNAHPGDTSHRBLM
SCHEMBL27580112 0.73
SCHEMBL28035277 0.72 PPARD (0.47) MEN1LMNAHPGDTSHRBLM
SCHEMBL37980 0.72
SCHEMBL946876 0.71
SCHEMBL3046597 0.71 PPARD (0.37) MEN1TSHRKMT2ATDP1PPARD
SCHEMBL1573318 0.69
Methyl Alcohol SCHEMBL29130741 0.69 PPARD (0.36) TSHRTDP1PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1436268-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Reddy's Laboratories Ltd. (IN) 2004-07-14 EP disclosed
WO-2003033481-A1 BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND PARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2003-04-24 WO disclosed