SCHEMBL6046763

SCHEMBL6046763

O=c1[nH]c(CO)cc2ccccc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.68
KDM4E B2RXH2 5/20 0.56
GAA P10253 3/20 0.56
CDC25B P30305 10/20 0.49
APAF1 O14727 6/20 0.49
CASP3 P42574 5/20 0.49
SENP8 Q96LD8 5/20 0.49
SENP7 Q9BQF6 5/20 0.49
ALDH1A1 P00352 5/20 0.49
SENP6 Q9GZR1 4/20 0.49
HPGD P15428 4/20 0.49
SAE1 Q9UBE0 4/20 0.49
UBA2 Q9UBT2 4/20 0.49
THRB P10828 4/20 0.49
MAPT P10636 3/20 0.49
RECQL P46063 2/20 0.49
UBE2I P63279 2/20 0.49
GALK1 P51570 1/20 0.49
SMAD3 P84022 1/20 0.49
ATG4B Q9Y4P1 1/20 0.49

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
SCHEMBL15303909 0.81 LOXL2 (1.00) LOXL2KDM4EGAACDC25BAPAF1
SCHEMBL1720643 0.81 LOXL2 (0.68) LOXL2KDM4EGAACDC25BAPAF1
SCHEMBL30249827 0.81 LOXL2 (1.00) LOXL2KDM4EGAACDC25BAPAF1
SCHEMBL7452968 0.81 LOXL2 (0.68) LOXL2KDM4EGAACDC25BAPAF1
SCHEMBL11665605 0.80 LOXL2 (0.62) LOXL2KDM4EGAACDC25BAPAF1
SCHEMBL2599466 0.78 LOXL2 (0.74) LOXL2KDM4EGAACDC25BAPAF1
SCHEMBL7106470 0.78 PARP1 (0.65) LOXL2KDM4EGAACDC25BAPAF1
SCHEMBL6603861 0.77 LOXL2 (0.62) LOXL2KDM4EGAACDC25BAPAF1
SCHEMBL6645515 0.77 TNKS (0.62) LOXL2KDM4EGAACDC25BAPAF1
SCHEMBL1687342 0.76 KDM4E (0.60) LOXL2KDM4EGAACDC25BAPAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060261267-A1 Composite MALDI matrix material and methods of using it and kits thereof in MALDI AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH 2006-11-23 US claimed
CN-107226807-B Tankyrase inhibitors 北京四环制药有限公司 2021-01-01 CN disclosed
US-20060261267-A1 Composite MALDI matrix material and methods of using it and kits thereof in MALDI AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH 2006-11-23 US disclosed