SCHEMBL7846422

SCHEMBL7846422

CCN1CCC(CCC(=O)c2ccc3c(c2)CCN(Cc2ccccc2)CC3)CC1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 18/20 0.76
BCHE P06276 1/20 0.65

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
SCHEMBL7846382 0.95 ACHE (0.84) ACHEBCHE
SCHEMBL7838185 0.92 ACHE (0.76) ACHEBCHE
SCHEMBL9208500 0.92 ACHE (0.79) ACHEBCHE
Hydrochloric Acid SCHEMBL9204483 0.91 ACHE (0.78) ACHEBCHE
Hydrochloric Acid SCHEMBL7227175 0.91 ACHE (0.74) ACHEBCHE
SCHEMBL7847227 0.90 ACHE (0.77) ACHE
SCHEMBL7227558 0.89 ACHE (0.72) ACHEBCHE
SCHEMBL13987085 0.89 ACHE (0.75) ACHEBCHE
SCHEMBL7850508 0.89 ACHE (0.74) ACHEBCHE
Hydrochloric Acid SCHEMBL7236184 0.88 ACHE (0.68) ACHEBCHE

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
EP-1122252-A1 NITROGENOUS FUSED HETEROCYCLE COMPOUNDS, PROCESS FOR THE PREPARATION THEREOF AND AGENTS CONTAINING THE SAME Takeda Chemical Industries, Ltd. (JP) 2001-08-08 EP disclosed