SCHEMBL6648965

SCHEMBL6648965

CN1CC[N]C(c2ccncc2)C1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.37
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
LMNA P02545 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 2/20 0.35
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
GSK3B P49841 1/20 0.32
TP53 P04637 2/20 0.32
SLC6A2 P23975 2/20 0.31
SLC6A4 P31645 2/20 0.31
SLC6A3 Q01959 2/20 0.31

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
SCHEMBL2203029 0.84 SLC6A2 (0.41) CYP1A2MAPTLMNASLC6A2SLC6A4
SCHEMBL5983948 0.82 SLC6A3 (0.37) L3MBTL1MAPTNPSR1LMNATDP1
SCHEMBL7705153 0.70 HTR1A (0.43) TP53SLC6A2SLC6A4SLC6A3
SCHEMBL24342627 0.69 L3MBTL1 (0.42) CYP1A2CYP2C19L3MBTL1MAPTNPSR1
SCHEMBL12049774 0.69 CYP1A2 (0.41) CYP1A2CYP2C19L3MBTL1MAPTNPSR1
SCHEMBL20611963 0.68 LSS (0.50) CYP1A2CYP2C19SLC6A2SLC6A4SLC6A3
SCHEMBL2749914 0.67 CYP1A2 (0.39) CYP1A2CYP2C19L3MBTL1MAPTNPSR1
SCHEMBL5981666 0.67 ALDH1A1 (0.35) L3MBTL1MAPTLMNATDP1
SCHEMBL24394595 0.67 GSK3B (0.45) CYP1A2GSK3BSLC6A2SLC6A4SLC6A3
SCHEMBL24342636 0.67 GSK3B (0.45) GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1478645-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS Amgen Inc. (US) 2004-11-24 EP disclosed
WO-2003066630-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS AMGEN INC. (US) 2003-08-14 WO disclosed
EP-1309589-A2 UREA COMPOUNDS AND METHODS OF USES Amgen Inc. (US) 2003-05-14 EP disclosed
WO-2002014311-A2 UREA COMPOUNDS AND METHODS OF USES AMGEN INC. (US) 2002-02-21 WO disclosed