SCHEMBL13524822

SCHEMBL13524822

Cc1ccc2c(c1)c(-c1ccc(F)cc1)c(/C=C/[C@@H]1C[C@@H](O)CC(=O)O1)n2C(C)C

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HMGCR P04035 6/20 0.54

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
SCHEMBL14075115 1.00 HMGCR (0.54) HMGCR
SCHEMBL14075120 0.94 HMGCR (0.53) HMGCR
SCHEMBL13847539 0.91 HMGCR (0.53) HMGCR
SCHEMBL13992372 0.91 HMGCR (0.54) HMGCR
SCHEMBL4901679 0.89 HMGCR (0.52) HMGCR
SCHEMBL4020685 0.89 HMGCR (0.52) HMGCR
SCHEMBL14544900 0.89 HMGCR (0.52) HMGCR
SCHEMBL9274196 0.89 HMGCR (0.52) HMGCR
SCHEMBL4901682 0.89 HMGCR (0.52) HMGCR
SCHEMBL4020679 0.89 HMGCR (0.52) HMGCR

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
US-7645747-B2 Improved pharmacokinetic properties, oral bioavailability; side effect reduction GILEAD SCIENCES, INC. (US) 2010-01-12 — — US disclosed
US-20090131372-A1 PHOSPHONATE ANALOGS FOR TREATING METABOLIC DISEASES CHEN JAMES M 2009-05-21 — — 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 (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-20090131372-A1 PHOSPHONATE ANALOGS FOR TREATING METABOLIC DISEASES PHOSPHO1, G6PC1, PC HMGCR 105/4885

“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.

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