SCHEMBL2066005

SCHEMBL2066005

CC(=O)Oc1cc(O)c(C)c(O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.54
LMNA P02545 3/20 0.50
MAPT P10636 4/20 0.44
KDM4E B2RXH2 4/20 0.44
TP53 P04637 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TTR P02766 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ACHE P22303 3/20 0.44
CYP4F2 P78329 1/20 0.43
CYP4A11 Q02928 1/20 0.43
BACE1 P56817 1/20 0.43
HSD17B10 Q99714 3/20 0.42
GAA P10253 2/20 0.42
HTT P42858 1/20 0.42
ELANE P08246 2/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
CYP19A1 P11511 1/20 0.41

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
SCHEMBL27625926 0.90 CYP3A4 (0.48) CYP3A4LMNAMAPTKDM4ETP53
SCHEMBL7094541 0.84 CYP3A4 (0.55) CYP3A4LMNAMAPTKDM4ETP53
SCHEMBL14351002 0.81 CYP3A4 (0.63) CYP3A4LMNAMAPTKDM4ETP53
SCHEMBL320560 0.81 CYP3A4 (0.63) CYP3A4LMNAMAPTKDM4ETP53
SCHEMBL20817107 0.80 CYP3A4 (0.52) CYP3A4LMNAMAPTKDM4ETP53
SCHEMBL2010436 0.80 LMNA (0.59) CYP3A4LMNAMAPTKDM4ETP53
SCHEMBL6364662 0.79 LMNA (0.52) CYP3A4LMNAMAPTKDM4ETP53
SCHEMBL8081555 0.78 TDP1 (0.58) CYP3A4LMNAMAPTKDM4ETP53
SCHEMBL6749439 0.78 LMNA (0.55) CYP3A4LMNAMAPTKDM4ETP53
SCHEMBL3292047 0.77 KDM4E (0.53) CYP3A4LMNAMAPTKDM4ETP53

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
US-8148572-B2 Compounds ASTRAZENECA AB (SE) 2012-04-03 US disclosed
US-20090192163-A1 Novel Compounds ASTRAZENECA AB (SE) 2009-07-30 US disclosed
EP-1937632-A1 NOVEL COMPOUNDS Astra Zeneca AB (SE) 2008-07-02 EP disclosed
WO-2007039736-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2007-04-12 WO disclosed
US-6872747-B2 Decalactones, method for making, and pharmaceuticals there from BIOTECMARIN GMBH (DE) 2005-03-29 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-20090192163-A1 Novel Compounds PAH, PC, DDC CYP3A4 66/4885LMNA 3189/4885MAPT 1713/4885

“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.