SCHEMBL8944872

SCHEMBL8944872

CCOC(=O)C1CN(C(c2ccccc2)(c2ccccc2)c2ccccc2)CCN1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.40
ALDH1A1 P00352 3/20 0.40
PKM P14618 2/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CYP2C19 P33261 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.38

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
SCHEMBL334587 0.82 MAPT (0.40) CYP2C19CYP1A2HSD17B10MAPT
SCHEMBL10362321 0.79 EIF2AK4 (0.35) KMT2AMAPT
SCHEMBL7660403 0.77 SIGMAR1 (0.48) KDM4EALDH1A1
SCHEMBL7801902 0.77 L3MBTL1 (0.54) KDM4EALDH1A1MEN1KMT2A
SCHEMBL5265583 0.76 CACNA1A (0.56) KDM4EALDH1A1RAB9ASLC6A2SLC6A4
SCHEMBL6925601 0.76 MEN1 (0.59) KDM4EALDH1A1PKMRAB9AMEN1
SCHEMBL4182909 0.75 SMN1; SMN2 (0.45) KDM4EALDH1A1RAB9ACYP2C19CYP2D6
SCHEMBL7241545 0.74 BCHE (0.36) KDM4E
SCHEMBL3407039 0.73 ALDH1A1 (0.52) KDM4EALDH1A1PKMMEN1KMT2A
SCHEMBL191625 0.72 HRH4 (0.39) KDM4EALDH1A1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110041309-B 2-carboxypiperazine-linked tacrine-8-amino (hydroxy) quinoline derivative and preparation and application thereof 广东工业大学 2022-01-28 CN disclosed
EP-0638568-B1 Substituted piperazines, their process of preparation and the pharmaceutical compositions containing them ADIR (FR) 1996-10-09 EP disclosed
US-5500426-A ADMINISTERED TO IMPROVE GLUCOSE TOLERANCE ADIR ET COMPAGNIE (FR) 1996-03-19 US disclosed
US-5492912-A IMPROVES GLUCOSE TOLERANCE ADIR ET COMPAGNIE (FR) 1996-02-20 US disclosed
EP-0638568-A1 Substituted piperazines, their process of preparation and the pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1995-02-15 EP disclosed