SCHEMBL6926883

SCHEMBL6926883

O=C1NC(=O)C(=Cc2cccc(NC(=O)c3cccc(O)c3C(=O)O)c2)S1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 4/20 0.53
PIM1 P11309 7/20 0.48
PIM2 Q9P1W9 7/20 0.48
PIM3 Q86V86 1/20 0.48
CISD1 Q9NZ45 5/20 0.47
MAOA P21397 2/20 0.47
MAOB P27338 2/20 0.47
HDAC4 P56524 2/20 0.46
HDAC8 Q9BY41 1/20 0.46
GSK3B P49841 2/20 0.46
PTP4A3 O75365 1/20 0.45
TTR P02766 1/20 0.45

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
SCHEMBL6926879 0.92 AKR1B1 (0.53) AKR1B1PIM1PIM2PIM3CISD1
SCHEMBL6926876 0.92 AKR1B1 (0.53) AKR1B1PIM1PIM2PIM3CISD1
SCHEMBL6928700 0.82 PIM1 (0.55) AKR1B1PIM1PIM2PIM3CISD1
SCHEMBL6930893 0.82 PIM1 (0.55) AKR1B1PIM1PIM2PIM3CISD1
SCHEMBL6928703 0.82 PIM1 (0.55) AKR1B1PIM1PIM2PIM3CISD1
SCHEMBL6930895 0.82 PIM1 (0.55) AKR1B1PIM1PIM2PIM3CISD1
SCHEMBL6928941 0.82 AKR1B1 (0.48) AKR1B1PIM1PIM2PIM3CISD1
SCHEMBL6928944 0.82 AKR1B1 (0.48) AKR1B1PIM1PIM2PIM3CISD1
SCHEMBL6927555 0.80 GSK3B (0.51) AKR1B1PIM1PIM2PIM3CISD1
SCHEMBL6927557 0.80 GSK3B (0.51) AKR1B1PIM1PIM2PIM3CISD1

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