SCHEMBL7946899

SCHEMBL7946899

COC(=O)Cc1cc2ccccc2c(=O)[nH]1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.54
KDM4E B2RXH2 6/20 0.50
GAA P10253 3/20 0.50
TSHR P16473 1/20 0.48
CDC25B P30305 7/20 0.47
THRB P10828 3/20 0.47
APAF1 O14727 3/20 0.46
CASP3 P42574 3/20 0.46
SENP8 Q96LD8 3/20 0.46
SENP7 Q9BQF6 3/20 0.46
SENP6 Q9GZR1 2/20 0.46
CASP6 P55212 2/20 0.46
EGFR P00533 2/20 0.46
KDM4A O75164 1/20 0.45
KDM4B O94953 1/20 0.45
POLB P06746 1/20 0.45
ALOX15 P16050 1/20 0.45
CASP1 P29466 1/20 0.45
KDM4D Q6B0I6 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
SCHEMBL17313462 0.83 TDP2 (0.47) LOXL2SMN1; SMN2KDM4ETSHRCDC25B
SCHEMBL8686875 0.81 MTNR1A (0.56) LOXL2SMN1; SMN2KDM4EGAATSHR
SCHEMBL11665605 0.81 LOXL2 (0.62) LOXL2KDM4EGAACDC25BTHRB
SCHEMBL3199606 0.76 EGFR (0.51) SMN1; SMN2KDM4ETSHREGFRPOLB
SCHEMBL6046763 0.75 LOXL2 (0.68) LOXL2SMN1; SMN2KDM4EGAACDC25B
SCHEMBL1720643 0.75 LOXL2 (0.68) LOXL2SMN1; SMN2KDM4EGAACDC25B
SCHEMBL30853483 0.75 KDM4E (0.53) LOXL2KDM4EGAACDC25BTHRB
SCHEMBL1872809 0.75 KDM4E (0.53) LOXL2KDM4EGAACDC25BTHRB
SCHEMBL7260927 0.75 LOXL2 (0.58) LOXL2SMN1; SMN2KDM4EGAACDC25B
SCHEMBL6645515 0.74 TNKS (0.62) LOXL2KDM4EGAACDC25BTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010039534-A2 VIRAL AND FUNGAL INHIBITORS GEORGETOWN UNIVERSITY (US) 2010-04-08 WO disclosed