SCHEMBL13891770

SCHEMBL13891770

O=CC1CCC(c2c3ccc(=O)c(O)c-3oc3c(O)c(O)ccc23)CC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNG2 P59768 10/20 0.57
GNB1 P62873 10/20 0.57
HPGD P15428 5/20 0.57
ALOX15 P16050 5/20 0.57
HSD17B10 Q99714 5/20 0.57
HSPA1A P0DMV8 4/20 0.57
HSPA8 P11142 4/20 0.57
CYP2C9 P11712 4/20 0.57
CYP2C19 P33261 4/20 0.57
CYP1A2 P05177 2/20 0.57
HIF1A Q16665 2/20 0.57
TSHR P16473 1/20 0.57
GRK2 P25098 1/20 0.57
PHLPP2 Q6ZVD8 1/20 0.57
BRCA1 P38398 3/20 0.50
GAPDH P04406 1/20 0.49
RAPGEF4 Q8WZA2 1/20 0.49
MAPK1 P28482 1/20 0.49
ALDH1A1 P00352 2/20 0.46
CDC25A P30304 1/20 0.46

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
SCHEMBL16556417 0.92 GNG2 (0.65) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL13891750 0.87 GNG2 (0.66) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL13891751 0.87 GNG2 (0.69) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL13891752 0.85 GNG2 (0.68) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL13320772 0.85 GNG2 (0.68) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL13352371 0.85 GNG2 (0.68) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL2779115 0.84 GNG2 (0.66) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL13891722 0.81 GNG2 (0.71) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL13891724 0.81 GNG2 (0.71) GNG2GNB1HPGDALOX15HSD17B10
SCHEMBL13891728 0.81 GNG2 (0.71) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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