SCHEMBL135297

SCHEMBL135297

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

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.34
GJB2 P29033 1/20 0.34
GJA1 P17302 1/20 0.34
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
HDAC4 P56524 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
SLC5A2 P31639 2/20 0.30
POLB P06746 2/20 0.30
SLC5A1 P13866 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
SCHEMBL136625 0.96 APLNR (0.36) APLNRGJB2GJA1NPC1RAB9A
SCHEMBL14511262 0.96 APLNR (0.36) APLNRGJB2GJA1NPC1RAB9A
SCHEMBL1097290 0.90 BCHE (0.36) CA1CA2
SCHEMBL135298 0.89 APLNR (0.34) APLNRCA1CA2
SCHEMBL14511261 0.85 GJB2 (0.36) GJB2GJA1CA1CA2HDAC4
SCHEMBL136626 0.84 APLNR (0.37) APLNRCA1CA2NPC1RAB9A
SCHEMBL23818771 0.79 SSTR1 (0.36) GJB2
SCHEMBL130438 0.79 APLNR (0.33) APLNR
SCHEMBL1097291 0.78 BCHE (0.36) GJB2CA1CA2
SCHEMBL1096197 0.75 BCHE (0.39)

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 10 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
EP-1556510-A2 OLIGONUCLEOTIDE ANALOGUES FOR DETECTING AND ANALYZING NUCLEIC ACIDS Exiqon A/S (DK) 2005-07-27 EP 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
WO-2004035819-A2 OLIGONUCLEOTIDE ANALOGUES FOR DETECTING AND ANALYZING NUCLEIC ACIDS EXIQON A/S (DK) 2004-04-29 WO 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 704/4885GJB2 3899/4885GJA1 4261/4885
US-20030224377-A1 Novel LNA compositions and uses thereof RNGTT, NCL, NSUN2 APLNR 1353/4885GJB2 2517/4885GJA1 2538/4885
US-20120157333-A1 OLIGONUCLEOTIDES USEFUL FOR DETECTING AND ANALYZING NUCLEIC ACIDS OF INTEREST UPF1, DCLRE1B, SNRPA1 APLNR 704/4885GJB2 3899/4885GJA1 4261/4885

“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.