SCHEMBL6317568

SCHEMBL6317568

COc1ccc2cc(C(CNc3nc(C)cc(C)n3)P3(=O)O[C@@H](C)[C@@H](C)O3)sc2c1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.36
MAPT P10636 6/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 2/20 0.35
NPSR1 Q6W5P4 3/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
RECQL P46063 1/20 0.33
CASP2 P42575 1/20 0.32
SLC2A1 P11166 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
ATAD2 Q6PL18 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL6318067 0.85 CA2 (0.34) CA2
SCHEMBL6318976 0.72 CA2 (0.32) CA2
SCHEMBL6402240 0.72 LMNA (0.34) MAPTLMNANPSR1MEN1KMT2A
SCHEMBL6326060 0.69 ABL1 (0.33) CA2MAPTKMT2AL3MBTL1NPC1
SCHEMBL6319871 0.68 ABL1 (0.35)
SCHEMBL6320139 0.67 ALPL (0.40) MAPTLMNAHTTMEN1KMT2A
SCHEMBL6325628 0.67 NPC1 (0.31) CA2MAPTLMNANPC1RAB9A
SCHEMBL6324560 0.66 ABL1 (0.33)
SCHEMBL6269289 0.66 CHRNA7 (0.31)
SCHEMBL6317959 0.65 ALPL (0.38) MAPTLMNAHTTMEN1KMT2A

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 CA2 2047/4885MAPT 4686/4885LMNA 144/4885

“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.