SCHEMBL2819693

SCHEMBL2819693

Cc1csc(-c2ccc(C34CCCN(CC3)C4)nn2)c1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.37
MET P08581 1/20 0.32
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 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
SCHEMBL2819756 0.83 CHRM2 (0.33) SCD
SCHEMBL5218777 0.81 HPGDS (0.33) SCDMETCCNCCDK8
SCHEMBL2820263 0.81 SLC6A2 (0.31)
Bromide SCHEMBL4465970 0.81 HPGDS (0.32) SCDMETCCNCCDK8
Hydrochloric Acid SCHEMBL2823335 0.80 SLC6A2 (0.30)
SCHEMBL668390 0.74 ACHE (0.36)
SCHEMBL2820671 0.72 OTUD7B (0.35)
SCHEMBL2819737 0.71 SCD (0.35) SCD
SCHEMBL2818964 0.71 NPC1 (0.41)
SCHEMBL2822113 0.71 ALDH1A1 (0.43)

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