SCHEMBL11287649

SCHEMBL11287649

Nc1cc([C]=O)ccc1N1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.55
ALDH1A1 P00352 3/20 0.55
LMNA P02545 2/20 0.55
SMN1; SMN2 Q16637 3/20 0.52
NPC1 O15118 1/20 0.52
MAPT P10636 4/20 0.49
LGMN Q99538 3/20 0.49
GAA P10253 2/20 0.49
POLB P06746 2/20 0.45
MEN1 O00255 1/20 0.45
THRB P10828 1/20 0.45
RECQL P46063 1/20 0.45
BLM P54132 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
ALDH3A1 P30838 1/20 0.42
ALDH1A3 P47895 1/20 0.42
S100B P04271 1/20 0.40
NCF1 P14598 1/20 0.39

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
SCHEMBL9424288 0.84 ALDH1A1 (0.55) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL11289375 0.82 SMN1; SMN2 (0.58) ALDH1A1LMNASMN1; SMN2NPC1MAPT
SCHEMBL11280001 0.81 HPGD (0.52) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL4377045 0.78 MAPT (0.71) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL31491393 0.78 MAPT (0.71) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL28153718 0.77 KDM4E (0.55) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL10953569 0.77 NOTUM (0.51) KDM4EALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL2711166 0.76 LGMN (0.74) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL3724717 0.75 KDM4E (0.67) KDM4EALDH1A1LMNASMN1; SMN2NPC1
SCHEMBL2711594 0.75 KDM4E (0.59) KDM4EALDH1A1LMNASMN1; SMN2NPC1

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
EP-0059688-A1 Pyridazinones, method for their preparation, pharmaceutical compositions containing these compounds and their use CIBA-GEIGY AG (CH) 1982-09-08 EP disclosed