SCHEMBL130438

SCHEMBL130438

COc1ccc(COC[C@@]2(COS(C)(=O)=O)O[C@@H]3OC(C)(C)O[C@@H]3[C@@H]2OCc2ccc(OC)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.33
GLA P06280 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MMP1 P03956 1/20 0.30
MMP3 P08254 1/20 0.30
MMP9 P14780 1/20 0.30
ADAM17 P78536 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
SCHEMBL133350 0.96 APLNR (0.36) APLNRGLANPSR1MEN1KMT2A
SCHEMBL14511263 0.96 APLNR (0.36) APLNRGLANPSR1MEN1KMT2A
SCHEMBL1097047 0.89 ALDH1A1 (0.32)
SCHEMBL14511264 0.85 MEN1 (0.35) GLANPSR1MEN1KMT2A
SCHEMBL132697 0.84 MEN1 (0.39) GLANPSR1MEN1KMT2A
SCHEMBL25277740 0.84 ALDH1A1 (0.34) MEN1KMT2A
SCHEMBL5845679 0.83 ALDH1A1 (0.31)
SCHEMBL135298 0.80 APLNR (0.34) APLNR
SCHEMBL135297 0.79 APLNR (0.34) APLNR
SCHEMBL20394083 0.78 ALDH1A1 (0.30)

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9464106-B2 Oligonucleotides useful for detecting and analyzing nucleic acids of interest EXIQON A/S (DK) 2016-10-11 US disclosed
US-20120157333-A1 OLIGONUCLEOTIDES USEFUL FOR DETECTING AND ANALYZING NUCLEIC ACIDS OF INTEREST EXIQON A/S (DK) 2012-06-21 US disclosed
EP-1446412-B1 NOVEL LNA COMPOSITIONS AND USES THEREOF EXIQON AS (DK) 2012-03-07 EP disclosed
US-20070117144-A1 Oligonucleotides useful for detecting and analyzing nucleic acids of interest EXIQON A/S (DK) 2007-05-24 US disclosed
US-7060809-B2 LNA compositions and uses thereof EXIQON A/S (DE) 2006-06-13 US disclosed
US-20040219565-A1 Oligonucleotides useful for detecting and analyzing nucleic acids of interest EXIQON A/S (DK) 2004-11-04 US disclosed
EP-1446412-A2 NOVEL LNA COMPOSITIONS AND USES THEREOF Exiqon A/S (DK) 2004-08-18 EP disclosed
US-20030224377-A1 Novel LNA compositions and uses thereof QIAGEN GMBH (DE) 2003-12-04 US disclosed
WO-2003020739-A2 NOVEL LNA COMPOSITIONS AND USES THEREOF EXIQON A/S (DK) 2003-03-13 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 (3 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-20040219565-A1 Oligonucleotides useful for detecting and analyzing nucleic acids of interest UPF1, DCLRE1B, SNRPA1 APLNR 704/4885GLA 2435/4885NPSR1 1963/4885
US-20030224377-A1 Novel LNA compositions and uses thereof RNGTT, NCL, NSUN2 APLNR 1353/4885GLA 2248/4885NPSR1 2135/4885
US-20120157333-A1 OLIGONUCLEOTIDES USEFUL FOR DETECTING AND ANALYZING NUCLEIC ACIDS OF INTEREST UPF1, DCLRE1B, SNRPA1 APLNR 704/4885GLA 2435/4885NPSR1 1963/4885

“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.