SCHEMBL6322811

SCHEMBL6322811

CCNP(=O)(OCC)C(CNc1cnc(C)cn1)Cc1ccc(O)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
NR3C2 P08235 1/20 0.33
NOTUM Q6P988 1/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
POLB P06746 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ABL1 P00519 1/20 0.31
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30

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
SCHEMBL6324258 0.86 NOTUM (0.33) NOTUMKDM4E
SCHEMBL6318605 0.76 NOTUM (0.33) NOTUMESR1ESR2
SCHEMBL6324641 0.67 BACE1 (0.35) NOTUM
SCHEMBL6324637 0.67 BACE1 (0.35) NOTUM
SCHEMBL6318633 0.66 MAPT (0.34) KDM4EABL1
SCHEMBL6306472 0.64 L3MBTL1 (0.38) NOTUMKDM4E
SCHEMBL6324863 0.63 L3MBTL1 (0.33) NOTUMKDM4E
SCHEMBL6325748 0.62 NOTUM (0.32) NOTUMKDM4EESR2
SCHEMBL6318706 0.61 ABL1 (0.30) ABL1
SCHEMBL6326014 0.61

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-20050143349-A1 Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels QUATRX PHARMACEUTICALS CO. 2005-06-30 US claimed
US-20050143349-A1 Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels QUATRX PHARMACEUTICALS CO. 2005-06-30 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-20050143349-A1 Phosphorus containing compounds useful for the regulation of LDL and Lp(a) levels APOB, LDLR, LPL NR3C1 390/4885PGR 396/4885NR3C2 314/4885

“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.