SCHEMBL2820671

SCHEMBL2820671

Cc1n[nH]c(C)c1-c1ccc(C23CCCN(CC2)C3)nn1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OTUD7B Q6GQQ9 2/20 0.35
KCNH2 Q12809 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
CHEK1 O14757 1/20 0.32
AKT2 P31751 1/20 0.32
MAPK1 P28482 1/20 0.30
MKNK1 Q9BUB5 1/20 0.30

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
SCHEMBL1482815 0.82 ALOX5AP (0.41) OTUD7BKCNH2HRH3CHEK1AKT2
SCHEMBL2819756 0.78 CHRM2 (0.33)
SCHEMBL2820263 0.76 SLC6A2 (0.31)
Hydrochloric Acid SCHEMBL2823335 0.75 SLC6A2 (0.30)
SCHEMBL668390 0.74 ACHE (0.36)
SCHEMBL2820232 0.73
Hydrochloric Acid SCHEMBL668528 0.72
SCHEMBL2819693 0.72 SCD (0.37)
SCHEMBL2819744 0.72
SCHEMBL2819737 0.71 SCD (0.35)

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-1922320-B1 DERIVATIVES OF 5-PYRIDAZINYL-1-AZABICYCLO[3.2.1]OCTANE, PREPARATION METHOD THEREOF AND USE OF SAME IN THERAPEUTICS SANOFI AVENTIS (FR) 2010-10-27 EP claimed