SCHEMBL651557

SCHEMBL651557

COC(C)OCCOC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
TSHR P16473 2/20 0.45
CHRM5 P08912 2/20 0.40
CHRM1 P11229 2/20 0.40
CHRM3 P20309 2/20 0.40
PGR P06401 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
HTR1A P08908 1/20 0.40
CHRNB2 P17787 1/20 0.40
TBXA2R P21731 1/20 0.40
CHRNB4 P30926 1/20 0.40
CHRNA3 P32297 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CHRNA10 Q9GZZ6 1/20 0.40
CHRNA9 Q9UGM1 1/20 0.40
ALOX15 P16050 1/20 0.39
GALR3 O60755 2/20 0.39

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
SCHEMBL6668046 0.89 ALDH1A1 (0.50) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL652060 0.81 ALDH1A1 (0.54) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL17789983 0.81 ALDH1A1 (0.43) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL4863944 0.80 THRB (0.52) ALDH1A1TSHRHTTTDP1
SCHEMBL13120306 0.80 ALDH1A1 (0.46) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL330791 0.79 ALDH1A1 (0.50) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL6362567 0.79 TSHR (0.30) TSHR
SCHEMBL11021303 0.78 LMNA (0.37) LMNA
SCHEMBL1174610 0.78 ALDH1A1 (0.41) ALDH1A1TSHRCHRM5CHRM1CHRM3
SCHEMBL9150298 0.78 ALDH1A1 (0.63) ALDH1A1TSHRCHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119667-B2 Carbonates of fenicol antibiotics SCHERING-PLOUGH ANIMAL HEALTH CORPORATION (US) 2012-02-21 US disclosed
US-8084643-B2 Nitrogen-containing esters of the secondary alcohol group of florfenicol and of its analogs,including salts; veterinary medicine; nonhydrolyzing as needed to maintain the prodrug in aqueous solution in the subjects system until appropriate; cattle drinking water; bovine respiratory disease INTERVET INC. (US) 2011-12-27 US disclosed
US-8044230-B2 Hydrolytic stability needed to maintain the prodrug in solution in the subject's system until appropriate conditions exist when the prodrug can hydrolyze, releasing the active compound INTERVET INC. (US) 2011-10-25 US disclosed
EP-1966129-B1 CARBONATES OF FENICOL ANTIBIOTICS SCHERING PLOUGH LTD (CH) 2011-08-17 EP disclosed
EP-2102154-A1 WATER-SOLUBLE PRODRUGS OF CHLORAMPHENICOL, THIAMPHENICOL, AND ANALOGS THEREOF Schering-Plough Ltd. (CH) 2009-09-23 EP disclosed
EP-2101750-A2 WATER-SOLUBLE PHENICOL PRODRUGS IN A LIPOPHILIC VEHICLE SYSTEM Schering-Plough Ltd. (CH) 2009-09-23 EP disclosed
EP-2091909-A1 WATER-SOLUBLE PRODRUGS OF FLORFENICOL AND ITS ANALOGS Schering-Plough Ltd. (CH) 2009-08-26 EP disclosed
EP-1966129-A2 CARBONATES OF FENICOL ANTIBIOTICS Schering-Plough Ltd. (CH) 2008-09-10 EP disclosed
US-20080188556-A1 Water-Soluble Prodrugs of Florfenicol and its Analogs SCHERING-PLOUGH ANIMAL HEALTH CORPORATION 2008-08-07 US disclosed
WO-2008076259-A1 WATER-SOLUBLE PRODRUGS OF FLORFENICOL AND ITS ANALOGS SCHERING-PLOUGH LTD. (CH) 2008-06-26 WO disclosed
US-20080153906-A1 Water-Soluble Phenicol Prodrugs in a Lipophilic Vehicle System INTERVET INC. 2008-06-26 US disclosed
WO-2008076256-A1 WATER-SOLUBLE PRODRUGS OF CHLORAMPHENICOL, THIAMPHENICOL, AND ANALOGS THEREOF SCHERING-PLOUGH LTD. (CH) 2008-06-26 WO disclosed
WO-2008076261-A2 WATER-SOLUBLE PHENICOL PRODRUGS IN A LIPOPHILIC VEHICLE SYSTEM SCHERING-PLOUGH LTD. (CH) 2008-06-26 WO disclosed
US-20080146640-A1 Water-Soluble Prodrugs of Chloramphenicol, Thiamphenicol, and Analogs Thereof SCHERING-PLOUGH LTD. (CH) 2008-06-19 US disclosed
WO-2007079010-A2 CARBONATES OF FENICOL ANTIBIOTICS SCHERING-PLOUGH LTD. (CH) 2007-07-12 WO disclosed
US-20070155799-A1 CARBONATES OF FENICOL ANTIBIOTICS INTERVET INC. 2007-07-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080153906-A1 Water-Soluble Phenicol Prodrugs in a Lipophilic Vehicle System BPHL, CYP4B1, CYP4A22 ALDH1A1 787/4885TSHR 2907/4885CHRM5 239/4885
US-20070155799-A1 CARBONATES OF FENICOL ANTIBIOTICS CYP4F3, TET1, CYP4F2 ALDH1A1 3459/4885TSHR 3125/4885CHRM5 2286/4885
US-20080188556-A1 Water-Soluble Prodrugs of Florfenicol and its Analogs PFAS, ADH5, SI ALDH1A1 312/4885TSHR 3559/4885CHRM5 2311/4885
US-20080146640-A1 Water-Soluble Prodrugs of Chloramphenicol, Thiamphenicol, and Analogs Thereof TREH, ADH5, CES2 ALDH1A1 11/4885TSHR 1911/4885CHRM5 3733/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.