SCHEMBL6929398

SCHEMBL6929398

O=C1NC(=O)C(=Cc2cccc(NC(=O)c3nccnc3C(=O)O)c2)S1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 4/20 0.52
CISD1 Q9NZ45 5/20 0.51
MAOB P27338 3/20 0.51
PIK3CD O00329 1/20 0.51
NPC1 O15118 1/20 0.51
CSNK2A2 P19784 1/20 0.51
PIK3CA P42336 1/20 0.51
PIK3CB P42338 1/20 0.51
MTOR P42345 1/20 0.51
PIK3CG P48736 1/20 0.51
CLK1 P49759 1/20 0.51
RAB9A P51151 1/20 0.51
CSNK2B P67870 1/20 0.51
CSNK2A1 P68400 1/20 0.51
DYRK1A Q13627 1/20 0.51
DYRK2 Q92630 1/20 0.51
DYRK1B Q9Y463 1/20 0.51
PIM1 P11309 7/20 0.50
PIM2 Q9P1W9 7/20 0.50
HDAC4 P56524 4/20 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
SCHEMBL6929394 1.00 AKR1B1 (0.52) AKR1B1CISD1MAOBPIK3CDNPC1
SCHEMBL6928941 0.90 AKR1B1 (0.48) AKR1B1CISD1MAOBPIK3CDNPC1
SCHEMBL6928944 0.90 AKR1B1 (0.48) AKR1B1CISD1MAOBPIK3CDNPC1
SCHEMBL6927557 0.82 GSK3B (0.51) AKR1B1CISD1MAOBPIM1PIM2
SCHEMBL6927555 0.82 GSK3B (0.51) AKR1B1CISD1MAOBPIM1PIM2
SCHEMBL6928700 0.80 PIM1 (0.55) AKR1B1CISD1MAOBPIM1PIM2
SCHEMBL6930893 0.80 PIM1 (0.55) AKR1B1CISD1MAOBPIM1PIM2
SCHEMBL6930895 0.80 PIM1 (0.55) AKR1B1CISD1MAOBPIM1PIM2
SCHEMBL6928703 0.80 PIM1 (0.55) AKR1B1CISD1MAOBPIM1PIM2
SCHEMBL6926876 0.79 AKR1B1 (0.53) AKR1B1CISD1MAOBPIM1PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6518268-B1 Telomerase inhibitors and methods of their use GERON CORPORATION 2003-02-11 US disclosed
WO-2001002377-A9 TELOMERASE INHIBITORS AND METHODS OF THEIR USE GERON CORP (US) 2001-10-11 WO disclosed
EP-1109796-A1 TELOMERASE INHIBITORS AND METHODS OF THEIR USE Geron Corporation (US) 2001-06-27 EP disclosed
WO-2001002377-A1 TELOMERASE INHIBITORS AND METHODS OF THEIR USE GERON CORPORATION (US) 2001-01-11 WO disclosed