SCHEMBL8553951

SCHEMBL8553951

O=c1cccc2[nH]c(=O)c3ccccc3cc1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.51
GAA P10253 4/20 0.51
ALDH1A1 P00352 4/20 0.49
HPGD P15428 4/20 0.49
NPC1 O15118 1/20 0.49
LMNA P02545 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
LOXL2 Q9Y4K0 1/20 0.49
CDC25B P30305 10/20 0.45
APAF1 O14727 6/20 0.45
CASP3 P42574 5/20 0.45
SENP8 Q96LD8 5/20 0.45
SENP7 Q9BQF6 5/20 0.45
SENP6 Q9GZR1 4/20 0.45
SAE1 Q9UBE0 4/20 0.45
UBA2 Q9UBT2 4/20 0.45
MAPT P10636 3/20 0.45
THRB P10828 3/20 0.45
RECQL P46063 2/20 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
SCHEMBL19290 0.79 KDR (0.61) KDM4EGAAALDH1A1HPGDNPC1
SCHEMBL509972 0.77 KDM4E (0.57) KDM4EGAAALDH1A1HPGDNPC1
SCHEMBL4674979 0.76 KDR (0.57) KDM4EGAAALDH1A1HPGDNPC1
SCHEMBL9754369 0.74 NOTUM (0.48) KDM4EGAAALDH1A1HPGDLOXL2
SCHEMBL30305373 0.73 KDR (0.78) KDM4EGAAALDH1A1HPGDNPC1
SCHEMBL29639160 0.73 TNKS (0.63) KDM4EGAAALDH1A1HPGDNPC1
SCHEMBL828493 0.73 TNKS (0.63) KDM4EGAAALDH1A1HPGDNPC1
SCHEMBL29817803 0.71 KDM4E (0.51) KDM4EGAAALDH1A1HPGDNPC1
SCHEMBL13316854 0.71 KDM4E (0.59) KDM4EGAAALDH1A1HPGDNPC1
SCHEMBL27031075 0.71 KDM4E (0.51) KDM4EGAAALDH1A1HPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0869954-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1998-10-14 EP disclosed
WO-1996031499-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1996-10-10 WO disclosed