SCHEMBL7272871

SCHEMBL7272871

O=C1/C(=C\CC2CCN(Cc3ccccc3)CC2)CCc2nc3ccccc3c(NCc3ccccc3)c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
ACHE P22303 5/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CXCR4 P61073 1/20 0.40
CTNNB1 P35222 2/20 0.39
TCF7L2 Q9NQB0 2/20 0.39
POLB P06746 1/20 0.39
RAD52 P43351 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
HIF1A Q16665 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
BCHE P06276 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
SCHEMBL7272877 1.00 KDM4E (0.41) KDM4EKMT2AMEN1HTTACHE
SCHEMBL7281624 0.92 ACHE (0.40) KDM4EKMT2AHTTACHEMAPT
SCHEMBL7281630 0.92 ACHE (0.40) KDM4EKMT2AHTTACHEMAPT
SCHEMBL7274740 0.90 ACHE (0.41) KDM4EKMT2AMEN1HTTACHE
SCHEMBL7274738 0.90 ACHE (0.41) KDM4EKMT2AMEN1HTTACHE
SCHEMBL7274046 0.87 ACHE (0.41) HTTACHEMAPTMAPK1NPSR1
Hydrochloric Acid SCHEMBL7282884 0.85 MEN1 (0.47) KDM4EKMT2AMEN1ACHEMAPT
Hydrochloric Acid SCHEMBL7282887 0.85 MEN1 (0.47) KDM4EKMT2AMEN1ACHEMAPT
SCHEMBL7272068 0.82 ACHE (0.41) KDM4EKMT2AHTTACHEMAPT
SCHEMBL7284054 0.79 ACHE (0.40) ACHEMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0481429-B1 Quinoline derivatives SS PHARMACEUTICAL CO (JP) 2001-01-24 EP disclosed
EP-0987262-A1 Quinoline derivatives SS PHARMACEUTICAL CO., LTD. (JP) 2000-03-22 EP disclosed
US-5300517-A Treating Alzheimer's SS PHARMACEUTICAL CO., LTD. (JP) 1994-04-05 US disclosed
US-5240934-A Cognition activators SS PHARMACEUTICAL CO., LTD. (JP) 1993-08-31 US disclosed
US-5190951-A Inhibitors of acetylcholinesterase, treatment of senile dementia SS PHARMACEUTICAL CO., LTD. (JP) 1993-03-02 US disclosed
EP-0481429-A2 Quinoline derivatives SS PHARMACEUTICAL CO., LTD. (JP) 1992-04-22 EP disclosed