SCHEMBL3524293

SCHEMBL3524293

O=C1CC[C@@](Cc2ccccc2)(C(=O)O)O1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
LMNA P02545 1/20 0.37
TSHR P16473 2/20 0.36
TACR1 P25103 2/20 0.36
TACR3 P29371 2/20 0.36
NR3C1 P04150 1/20 0.36
AR P10275 1/20 0.36
HSD11B1 P28845 1/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NR3C2 P08235 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ELANE P08246 1/20 0.34

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
SCHEMBL3524295 1.00 MAOA (0.38) MAOAMAOBLMNATSHRTACR1
SCHEMBL6297140 0.86 HTT (0.35) MAOBHSD11B1NR3C2
SCHEMBL6303554 0.84 LMNA (0.40) LMNANR3C2MEN1KMT2A
SCHEMBL4608649 0.83 DDB1 (0.50) DDB1CRBN
SCHEMBL6297349 0.77 DDB1 (0.44) DDB1CRBNKMT2A
SCHEMBL13589960 0.74 CYP2C19 (0.35) LMNATSHRHSD11B1
SCHEMBL10027901 0.74 CYP2C19 (0.35) LMNATSHRHSD11B1
SCHEMBL5798686 0.74 PPARG (0.40)
SCHEMBL6299105 0.73 MAOA (0.40) MAOAMAOBLMNANR3C1DDB1
SCHEMBL8261141 0.73 MMP9 (0.45)

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-7807677-B2 HIV protease inhibitors MEDIVIR AB (SE) 2010-10-05 US disclosed
EP-1851193-B1 HIV PROTEASE INHIBITORS MEDIVIR AB (SE) 2009-04-22 EP disclosed
US-20080249102-A1 Hiv Protease Inhibitors MEDIVIR AB (SE) 2008-10-09 US disclosed
EP-1851193-A1 HIV PROTEASE INHIBITORS MEDIVIR AB (SE) 2007-11-07 EP disclosed
WO-2006084688-A1 HIV protease inhibitors MEDIVIR AB (SE) 2006-08-17 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-20080249102-A1 Hiv Protease Inhibitors SERPINB1, ANPEP, XPNPEP1 MAOA 475/4885MAOB 890/4885LMNA 534/4885

“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.