SCHEMBL5761969

SCHEMBL5761969

CC1(C2CCCC2)CC(=O)CC(=O)O1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
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
SCHEMBL5881035 0.77 LMNA (0.38) TSHRLMNA
SCHEMBL5880813 0.70 LMNA (0.33) TSHRLMNA
SCHEMBL5912277 0.69 LMNA (0.35) LMNAALDH1A1CYP2C9GAA
SCHEMBL3991120 0.68 LMNA (0.32) TSHRLMNA
SCHEMBL8117407 0.67 LMNA (0.42) TSHRLMNA
SCHEMBL3987983 0.66 CTSD (0.32) TSHRLMNA
SCHEMBL3991115 0.66 LMNA (0.33) TSHRLMNA
SCHEMBL4298710 0.66 LMNA (0.33) TSHRLMNAALDH1A1CYP3A4CYP2C9
SCHEMBL8115022 0.66 LMNA (0.41) TSHRLMNA
SCHEMBL8115140 0.63 APP (0.32) TSHRLMNA

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
EP-1490350-B1 PYRANON AND PYRANDION INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE PFIZER (US) 2006-08-23 EP disclosed
US-6878727-B2 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same AGOURON PHARMACEUTICALS, INC. (US) 2005-04-12 US disclosed
EP-1490350-A1 PYRANON AND PYRANDION INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE PFIZER INC. (US) 2004-12-29 EP disclosed
US-20030195239-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same PFIZER INC. 2003-10-16 US disclosed
WO-2003082848-A1 PYRANON AND PYRANDION INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE PFIZER INC. (US) 2003-10-09 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-20030195239-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same POLRMT, RNGTT, RNASE1 TSHR 4398/4885LMNA 3489/4885ALDH1A1 729/4885

“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.