SCHEMBL3147035

SCHEMBL3147035

Cc1ncc(OCC2(CN)CC2)cc1-c1ccc(N)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.34
APP P05067 3/20 0.32
BACE1 P56817 1/20 0.32
FYN P06241 1/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
TLR9 Q9NR96 1/20 0.31
TLR8 Q9NR97 1/20 0.31
TLR7 Q9NYK1 1/20 0.31
NUDT1 P36639 1/20 0.31
PRKCZ Q05513 1/20 0.30
FFAR4 Q5NUL3 3/20 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
Hydrochloric Acid SCHEMBL3781375 0.99 ABL1 (0.34) ABL1APPBACE1FYNMAPT
SCHEMBL3143028 0.89 CHRNB4 (0.39) APPBACE1MAPT
Hydrochloric Acid SCHEMBL3773920 0.88 CHRNB4 (0.39) APPBACE1MAPT
SCHEMBL3144019 0.87 FYN (0.37) ABL1FYN
Hydrochloric Acid SCHEMBL3774548 0.86 PRKCZ (0.32) APPNUDT1PRKCZFFAR4
SCHEMBL3138283 0.85 CHRNB4 (0.40) FFAR4
Hydrochloric Acid SCHEMBL3767949 0.84 CHRNB4 (0.39) FFAR4
SCHEMBL3147209 0.83 ABL1 (0.39) ABL1FFAR4
SCHEMBL3145347 0.81 DHFR (0.37) APPBACE1FYN
Hydrochloric Acid SCHEMBL3773421 0.80 DHFR (0.36) FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1979321-B9 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2010-02-17 EP disclosed
EP-1979321-B1 NOVEL PYRIDINYLAMINOALKYLENE- AND PYRIDINYLOXYALKYLENE-CYCLOPROPANAMINES, PROCESS FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SERVIER LAB (FR) 2009-07-29 EP disclosed