SCHEMBL6928986

SCHEMBL6928986

O=C1NC(=O)C(=Cc2ccc(Oc3ccc(S(=O)(=O)Nc4ccccc4)cc3)cc2)S1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.68
AKR1B1 P15121 3/20 0.68
MMP3 P08254 1/20 0.56
MMP13 P45452 1/20 0.56
XDH P47989 1/20 0.56
PIM1 P11309 2/20 0.55
PIM2 Q9P1W9 2/20 0.55
PIM3 Q86V86 1/20 0.55
PGR P06401 3/20 0.52
PTPN1 P18031 2/20 0.52
POLB P06746 1/20 0.52
MAOA P21397 1/20 0.52
MAOB P27338 1/20 0.52
MEN1 O00255 1/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 1/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NR1H4 Q96RI1 1/20 0.51

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
SCHEMBL6928982 1.00 HPGD (0.68) HPGDAKR1B1MMP3MMP13XDH
SCHEMBL6927788 0.89 AKR1B1 (0.58) HPGDAKR1B1MMP3MMP13XDH
SCHEMBL6927012 0.89 PIM1 (0.58) HPGDAKR1B1PIM1PIM2PGR
SCHEMBL6927009 0.89 PIM1 (0.58) HPGDAKR1B1PIM1PIM2PGR
SCHEMBL6928730 0.89 PIM1 (0.58) HPGDAKR1B1PIM1PIM2PTPN1
SCHEMBL6926478 0.89 AKR1B1 (0.64) HPGDAKR1B1PIM1PIM2PGR
SCHEMBL6927790 0.89 AKR1B1 (0.58) HPGDAKR1B1MMP3MMP13XDH
SCHEMBL6928727 0.89 PIM1 (0.58) HPGDAKR1B1PIM1PIM2PTPN1
SCHEMBL6926481 0.89 AKR1B1 (0.64) HPGDAKR1B1PIM1PIM2PGR
SCHEMBL6927204 0.87 AKR1B1 (0.59) HPGDAKR1B1MMP3MMP13XDH

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