SCHEMBL7380504

SCHEMBL7380504

CCCCOC(=O)NCCNC(=O)COCCOCCN

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.50
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
FAAH O00519 1/20 0.40

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
SCHEMBL30786562 0.87 ACHE (0.57) ACHE
SCHEMBL30786561 0.87 ACHE (0.57) ACHE
SCHEMBL30733875 0.87 ACHE (0.57) ACHE
SCHEMBL4622478 0.85 ACHE (0.59) ACHE
SCHEMBL20706221 0.85 TSHR (0.47) ACHETSHRRECQLFAAH
SCHEMBL7380506 0.83 ACHE (0.47) ACHETSHRRECQLFAAH
SCHEMBL8214500 0.82 GLP1R (0.46) ACHETSHRRECQLFAAH
SCHEMBL17227467 0.82 FAAH (0.55) TSHRRECQLFAAH
SCHEMBL21297376 0.82 GLP1R (0.46) ACHETSHRRECQLFAAH
SCHEMBL24838579 0.82 TSHR (0.39) ACHETSHRRECQLFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002070521-A1 NOVEL METALLOPROTEINASE INHIBITOR DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM LES LABORATOIRES SERVIER (FR) 2002-09-12 WO disclosed