SCHEMBL9564467

SCHEMBL9564467

CN1CCN(c2cc3c(cc2N)c(=O)cc(C(=O)O)n3C2CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.41
ALDH1A1 P00352 6/20 0.41
HSD17B10 Q99714 3/20 0.41
DRD3 P35462 1/20 0.37
ALK Q9UM73 4/20 0.37
GAA P10253 3/20 0.37
POLB P06746 2/20 0.37
NR4A1 P22736 1/20 0.37
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
RECQL P46063 1/20 0.36
PTK2B Q14289 1/20 0.36
ADRA2C P18825 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HPGD P15428 2/20 0.35
NPC1 O15118 1/20 0.34

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
SCHEMBL9564472 0.90 KDM4E (0.42) KDM4EALDH1A1HSD17B10GAAPOLB
SCHEMBL9564482 0.87 KDM4E (0.38) KDM4EALDH1A1HSD17B10GAAPOLB
SCHEMBL9564465 0.86 HSD17B10 (0.45) KDM4EALDH1A1HSD17B10GAAPOLB
SCHEMBL9564469 0.85 LGMN (0.41) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL9564477 0.83 PIM1 (0.43) KDM4EALDH1A1HSD17B10GAAPOLB
SCHEMBL9564496 0.82 KCNH2 (0.38) KDM4EHSD17B10GAAPOLBNR4A1
SCHEMBL9564483 0.79 PIK3CA (0.37) ALDH1A1HSD17B10MAPK1MEN1KMT2A
Hydrochloric Acid SCHEMBL9564479 0.78 SCN5A (0.34) KDM4EALDH1A1HSD17B10POLBMAPK1
SCHEMBL9564460 0.78 LMNA (0.49) KDM4EALDH1A1HSD17B10DRD3GAA
SCHEMBL10377651 0.75 ALDH1A1 (0.63) KDM4EALDH1A1HSD17B10DRD3GAA

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
JP-5239028-A None JP disclosed
JP-H05239028-A 6-AMINOQUINOLONE, ITS SYNTHESIS AND ITS USE AS ANTIBACTERIAL SUBSTANCE MEDIOLANUM FARMACEUT SRL 1993-09-17 JP disclosed
EP-0531958-A1 6-Aminoquinolones, their synthesis and their use as antibacterial agents MEDIOLANUM FARMACEUTICI S.P.A. (IT) 1993-03-17 EP disclosed