SCHEMBL2846323

SCHEMBL2846323

O=C(O)/C=C/c1c2ccc(=O)c(O)c-2oc2c(O)c(O)ccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNG2 P59768 9/20 1.00
GNB1 P62873 9/20 1.00
HPGD P15428 6/20 1.00
ALOX15 P16050 6/20 1.00
HSD17B10 Q99714 6/20 1.00
HSPA1A P0DMV8 4/20 1.00
HSPA8 P11142 4/20 1.00
CYP2C9 P11712 4/20 1.00
CYP2C19 P33261 4/20 1.00
BRCA1 P38398 3/20 1.00
MAPK1 P28482 2/20 1.00
GAPDH P04406 1/20 1.00
RAPGEF4 Q8WZA2 1/20 1.00
ALDH1A1 P00352 3/20 0.56
HIF1A Q16665 2/20 0.56
CDC25A P30304 1/20 0.56
CDC25B P30305 1/20 0.56
STAT6 P42226 1/20 0.56
CYP1A2 P05177 2/20 0.50
TSHR P16473 1/20 0.50

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
SCHEMBL2846330 1.00 GNG2 (1.00) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL13771874 0.74 HPGD (0.77) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL13352283 0.72 GNG2 (0.71) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL29986877 0.72 HPGD (1.00) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL5080754 0.72 HPGD (1.00) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL2848109 0.71 GNG2 (0.65) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL7125963 0.71 GNG2 (0.61) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL2777300 0.70 GNG2 (1.00) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL16556417 0.69 GNG2 (0.65) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL2779115 0.68 GNG2 (0.66) GNG2GNB1HPGDALOX15HSD17B10

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080306031-A1 Methods of Inhibiting Poxvirus Growth SALK INSTITUTE FOR BIOLOGICAL STUDIES 2008-12-11 US claimed
WO-2007047339-A2 METHODS OF INHIBITING POXVIRUS GROWTH THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2007-04-26 WO claimed
US-8975259-B2 Compositions and methods for inhibiting G protein signaling UNIVERSITY OF ROCHESTER (US) 2015-03-10 US disclosed
US-8975259-B2 Compositions and methods for inhibiting G protein signaling UNIVERSITY OF ROCHESTER (US) 2015-03-10 US disclosed
US-8975259-B2 Compositions and methods for inhibiting G protein signaling UNIVERSITY OF ROCHESTER (US) 2015-03-10 US disclosed
US-8748480-B2 Methods for treating opioid tolerance UNIVERSITY OF ROCHESTER (US) 2014-06-10 US disclosed
US-8748480-B2 Methods for treating opioid tolerance UNIVERSITY OF ROCHESTER (US) 2014-06-10 US disclosed
US-20130116313-A1 Compositions and Methods for Inhibiting G Protein Signaling UNIVERSITY OF ROCHESTER (US) 2013-05-09 US disclosed
US-20130116313-A1 Compositions and Methods for Inhibiting G Protein Signaling UNIVERSITY OF ROCHESTER (US) 2013-05-09 US disclosed
US-8076375-B2 Methods of inhibiting poxvirus growth THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2011-12-13 US disclosed
US-20100130505-A1 COMPOSITIONS AND METHODS FOR INHIBITING G PROTEIN SIGNALING UNIVERSITY OF ROCHESTER (US) 2010-05-27 US disclosed
US-20100130505-A1 COMPOSITIONS AND METHODS FOR INHIBITING G PROTEIN SIGNALING UNIVERSITY OF ROCHESTER (US) 2010-05-27 US disclosed
US-20090221691-A1 COMPOSITIONS AND METHODS FOR INHIBITING G PROTEIN SIGNALING UNIVERSITY OF ROCHESTER (US) 2009-09-03 US disclosed
US-20090221691-A1 COMPOSITIONS AND METHODS FOR INHIBITING G PROTEIN SIGNALING UNIVERSITY OF ROCHESTER (US) 2009-09-03 US disclosed
US-20090118135-A1 METHODS AND COMPOUNDS FOR REGULATING APOPTOSIS THE BURNHAM INSTITUTE (US) 2009-05-07 US disclosed
US-20090118135-A1 METHODS AND COMPOUNDS FOR REGULATING APOPTOSIS THE BURNHAM INSTITUTE (US) 2009-05-07 US disclosed
WO-2009020677-A9 COMPOSITIONS AND METHODS FOR INHIBITING G PROTEIN SIGNALING UNIV ROCHESTER (US) 2009-04-16 WO disclosed
WO-2009020677-A2 COMPOSITIONS AND METHODS FOR INHIBITING G PROTEIN SIGNALING UNIVERSITY OF ROCHESTER (US) 2009-02-12 WO disclosed
US-20080306031-A1 Methods of Inhibiting Poxvirus Growth SALK INSTITUTE FOR BIOLOGICAL STUDIES 2008-12-11 US disclosed
WO-2007047339-A2 METHODS OF INHIBITING POXVIRUS GROWTH THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2007-04-26 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 (5 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-20090118135-A1 METHODS AND COMPOUNDS FOR REGULATING APOPTOSIS BCL2, BAX, BAD GNG2 1544/4885GNB1 1702/4885HPGD 2147/4885
US-20130116313-A1 Compositions and Methods for Inhibiting G Protein Signaling GNAI3, GNAI1, GNAI2 GNG2 7/4885GNB1 4/4885HPGD 2898/4885
US-20100130505-A1 COMPOSITIONS AND METHODS FOR INHIBITING G PROTEIN SIGNALING GNAI1, GNAI3, GNAI2 GNG2 5/4885GNB1 4/4885HPGD 2169/4885
US-20090221691-A1 COMPOSITIONS AND METHODS FOR INHIBITING G PROTEIN SIGNALING GNAI3, GNAI1, GNAI2 GNG2 7/4885GNB1 4/4885HPGD 3003/4885
US-20080306031-A1 Methods of Inhibiting Poxvirus Growth TTK, TXK, DCK GNG2 1859/4885GNB1 1418/4885HPGD 2912/4885

“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.