SCHEMBL5378331

SCHEMBL5378331

NC(=O)c1ccc2[nH]c(N3CCC(Cc4ccc(F)cc4)CC3)cc2c1Cl

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 3/20 0.42
GRIN2B Q13224 3/20 0.42
GRIN2D O15399 2/20 0.42
GRIN3B O60391 2/20 0.42
GRIN2A Q12879 2/20 0.42
GRIN2C Q14957 2/20 0.42
GRIN3A Q8TCU5 2/20 0.42
MAPK14 Q16539 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL5383885 0.90 GPR84 (0.51) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL5374169 0.86 MAPK14 (0.42) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL5376292 0.83 MAPK14 (0.46) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL5372928 0.78 MAPK14 (0.48) MAPK14MEN1KMT2A
SCHEMBL5365951 0.76 MEN1 (0.52) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL5376322 0.74 GPR84 (0.51) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL5378327 0.74 CCR3 (0.40) GRIN1GRIN2BMAPK14
SCHEMBL5374691 0.73 GAA (0.47) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL5387265 0.73 GPR84 (0.52) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A
SCHEMBL5374207 0.73 GPR84 (0.52) GRIN1GRIN2BGRIN2DGRIN3BGRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7189739-B2 Compounds and methods to treat cardiac failure and other disorders SCIOS, INC. (US) 2007-03-13 US claimed
EP-1080078-B1 HETEROCYCLIC COMPOUNDS AND METHODS TO TREAT CARDIAC FAILURE AND OTHER DISORDERS SCIOS INC (US) 2006-02-01 EP claimed
EP-1080078-A1 HETEROCYCLIC COMPOUNDS AND METHODS TO TREAT CARDIAC FAILURE AND OTHER DISORDERS SCIOS INC. (US) 2001-03-07 EP claimed
WO-1999061426-A1 HETEROCYCLIC COMPOUNDS AND METHODS TO TREAT CARDIAC FAILURE AND OTHER DISORDERS SCIOS INC. (US) 1999-12-02 WO claimed
US-7189739-B2 Compounds and methods to treat cardiac failure and other disorders SCIOS, INC. (US) 2007-03-13 US disclosed
EP-1080078-B1 HETEROCYCLIC COMPOUNDS AND METHODS TO TREAT CARDIAC FAILURE AND OTHER DISORDERS SCIOS INC (US) 2006-02-01 EP disclosed
US-6589954-B1 Indoles, benzimidazoles and benztriazoles which are substituted at the 5 or 6 position with a substituent comprising an aromatic moiety linked through a piperazine ring to said indole, benzimidazole or benztriazole are useful SCIOS, INC. 2003-07-08 US disclosed
US-6340685-B1 ANTIINFLAMMATORY AGENTS SCIOS, INC. 2002-01-22 US disclosed
EP-1080078-A1 HETEROCYCLIC COMPOUNDS AND METHODS TO TREAT CARDIAC FAILURE AND OTHER DISORDERS SCIOS INC. (US) 2001-03-07 EP disclosed
WO-1999061426-A1 HETEROCYCLIC COMPOUNDS AND METHODS TO TREAT CARDIAC FAILURE AND OTHER DISORDERS SCIOS INC. (US) 1999-12-02 WO disclosed