SCHEMBL5014318

SCHEMBL5014318

CC(CO)(COC(=O)CI)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 1/20 0.37

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
SCHEMBL5011849 0.90 TSHR (0.41) CYP2D6TSHRCYP2C19HIF1A
SCHEMBL5014370 0.82 CYP2D6 (0.38) CYP2D6TSHRCYP2C19HIF1A
SCHEMBL15385469 0.81 MGAM (0.35) CYP2D6TSHRCYP2C19HIF1A
SCHEMBL17304528 0.79 TSHR (0.39) CYP2D6TSHRCYP2C19HIF1A
SCHEMBL1086977 0.79 TSHR (0.39) CYP2D6TSHRCYP2C19HIF1A
SCHEMBL17680158 0.78 CYP2D6 (0.38) CYP2D6TSHRCYP2C19HIF1A
SCHEMBL10705639 0.75 DGKA (0.53) TSHR
SCHEMBL17678860 0.75 TSHR (0.39) CYP2D6TSHRCYP2C19HIF1A
SCHEMBL2022933 0.74 CYP2D6 (0.35) CYP2D6TSHRCYP2C19HIF1A
SCHEMBL9245665 0.74 TSHR (0.42) CYP2D6TSHRCYP2C19HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1319008-B1 WATER SOLUBLE RAPAMYCIN ESTERS WYETH CORP (US) 2008-10-15 EP claimed
EP-1319008-A2 WATER SOLUBLE RAPAMYCIN ESTERS Wyeth (US) 2003-06-18 EP claimed
US-6432973-B1 POLYOXYETHYLATED HYDROXYESTERS OF RAPAMYCIN USEFUL IN INDUCING IMMUNOSUPPRESSION AND IN THE TREATMENT OF TRANSPLANTATION REJECTION, AUTOIMMUNE DISEASES, SOLID TUMORS, FUNGAL INFECTIONS, AND VASCULAR DISEASE. WYETH 2002-08-13 US claimed
US-20020055518-A1 Water soluble rapamycin esters AMERICAN HOME PRODUCTS CORPORATION (US) 2002-05-09 US claimed
WO-2002024706-A2 WATER SOLUBLE RAPAMYCIN ESTERS WYETH (US) 2002-03-28 WO claimed
EP-1319008-B1 WATER SOLUBLE RAPAMYCIN ESTERS WYETH CORP (US) 2008-10-15 EP disclosed
EP-1319008-A2 WATER SOLUBLE RAPAMYCIN ESTERS Wyeth (US) 2003-06-18 EP disclosed
US-6432973-B1 POLYOXYETHYLATED HYDROXYESTERS OF RAPAMYCIN USEFUL IN INDUCING IMMUNOSUPPRESSION AND IN THE TREATMENT OF TRANSPLANTATION REJECTION, AUTOIMMUNE DISEASES, SOLID TUMORS, FUNGAL INFECTIONS, AND VASCULAR DISEASE. WYETH 2002-08-13 US disclosed
US-20020055518-A1 Water soluble rapamycin esters AMERICAN HOME PRODUCTS CORPORATION (US) 2002-05-09 US disclosed
WO-2002024706-A2 WATER SOLUBLE RAPAMYCIN ESTERS WYETH (US) 2002-03-28 WO 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 (1 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-20020055518-A1 Water soluble rapamycin esters RICTOR, MTOR, RPTOR CYP2D6 2935/4885TSHR 3480/4885CYP2C19 1757/4885

“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.