SCHEMBL6927557

SCHEMBL6927557

O=C1NC(=O)C(=Cc2cccc(NC(=O)c3cnccc3C(=O)O)c2)S1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.51
AKR1B1 P15121 4/20 0.48
CISD1 Q9NZ45 6/20 0.47
MAOA P21397 3/20 0.47
PIM1 P11309 7/20 0.46
PIM2 Q9P1W9 7/20 0.46
PIM3 Q86V86 1/20 0.46
MAOB P27338 2/20 0.46
HDAC4 P56524 3/20 0.45
HDAC8 Q9BY41 2/20 0.45
TTR P02766 1/20 0.43

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
SCHEMBL6927555 1.00 GSK3B (0.51) GSK3BAKR1B1CISD1MAOAPIM1
SCHEMBL6928700 0.83 PIM1 (0.55) AKR1B1CISD1MAOAPIM1PIM2
SCHEMBL6928703 0.83 PIM1 (0.55) AKR1B1CISD1MAOAPIM1PIM2
SCHEMBL6928941 0.82 AKR1B1 (0.48) GSK3BAKR1B1CISD1MAOAPIM1
SCHEMBL6928944 0.82 AKR1B1 (0.48) GSK3BAKR1B1CISD1MAOAPIM1
SCHEMBL6929398 0.82 AKR1B1 (0.52) GSK3BAKR1B1CISD1MAOAPIM1
SCHEMBL6929394 0.82 AKR1B1 (0.52) GSK3BAKR1B1CISD1MAOAPIM1
SCHEMBL6925733 0.81 ADAMTS5 (0.52) GSK3BAKR1B1CISD1MAOAPIM1
SCHEMBL6925735 0.81 ADAMTS5 (0.52) GSK3BAKR1B1CISD1MAOAPIM1
SCHEMBL6926876 0.80 AKR1B1 (0.53) GSK3BAKR1B1CISD1MAOAPIM1

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