SCHEMBL17764153

SCHEMBL17764153

CCOC(=O)NC1CCc2ccc(OCCNSc3cn(C)cn3)cc2C1Cc1ccccc1Cl

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 19/20 0.54
KCNH2 Q12809 1/20 0.41
ATM Q13315 1/20 0.33

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
SCHEMBL3099188 0.86 SLC6A9 (0.74) SLC6A9KCNH2
SCHEMBL3101353 0.81 SLC6A9 (0.58) SLC6A9KCNH2
SCHEMBL3107883 0.76 SLC6A9 (0.74) SLC6A9KCNH2
SCHEMBL3101590 0.75 SLC6A9 (0.74) SLC6A9KCNH2
SCHEMBL7898500 0.74 SLC6A9 (0.82) SLC6A9KCNH2
SCHEMBL3089765 0.73 SLC6A9 (0.58) SLC6A9KCNH2
SCHEMBL3097604 0.72 SLC6A9 (0.55) SLC6A9KCNH2
SCHEMBL3100798 0.72 SLC6A9 (0.55) SLC6A9
SCHEMBL7893902 0.71 SLC6A9 (0.71) SLC6A9KCNH2
SCHEMBL7895349 0.71 SLC6A9 (0.70) SLC6A9KCNH2

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-2396296-B1 AMINOTETRALINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY ABBVIE DEUTSCHLAND (DE) 2016-05-25 EP claimed