SCHEMBL6141524

SCHEMBL6141524

CN(C)CCN(C)c1ccccc1CC=O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.37
MEN1 O00255 1/20 0.33
TNNI3 P19429 1/20 0.33
TNNT2 P45379 1/20 0.33
TNNC1 P63316 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTR2A P28223 1/20 0.32
HRH1 P35367 1/20 0.32
NPY2R P49146 1/20 0.32

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
SCHEMBL19661689 0.82 TAAR1 (0.41) TAAR1MEN1TNNI3TNNT2TNNC1
SCHEMBL1254040 0.80 ATP4A (0.44) MAPTALDH1A1CYP2D6
SCHEMBL16795582 0.77 MAOA (0.43) ALDH1A1CYP2D6
SCHEMBL2425306 0.77 MEN1 (0.44) TAAR1MEN1TNNI3TNNT2TNNC1
SCHEMBL16310159 0.77 AOC3 (0.34) MAPTALDH1A1
SCHEMBL6141114 0.76 MEN1 (0.49) TAAR1MEN1TNNI3TNNT2TNNC1
SCHEMBL9050053 0.74 MEN1 (0.35) MEN1KMT2AALDH1A1
SCHEMBL27610581 0.73 AR (0.43) MEN1KMT2AMAPTALDH1A1
SCHEMBL8677186 0.72 SLC6A4 (0.43) MEN1KMT2AALDH1A1CYP2D6CYP2C19
SCHEMBL2572183 0.70 PYCR1 (0.43) MEN1KMT2AALDH1A1CYP2D6CYP2C19

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-1515940-A2 AMINOALKOXY-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2005-03-23 EP disclosed
WO-2003097574-A2 AMINOALKOXY-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2003-11-27 WO disclosed