SCHEMBL5915596

SCHEMBL5915596

CN(C)Cc1ccc(-c2ccccc2)cc1C=O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.49
ALDH1A1 P00352 3/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
ERN1 O75460 4/20 0.40
PTPN1 P18031 3/20 0.39
PTPN2 P17706 2/20 0.39
USP2 O75604 1/20 0.39
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
SRC P12931 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
TSHR P16473 1/20 0.37
BRD4 O60885 1/20 0.36
BRD9 Q9H8M2 1/20 0.36

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
SCHEMBL6141669 0.94 TAAR1 (0.60) TAAR1ALDH1A1KDM4EMEN1MAPT
SCHEMBL13037433 0.89 TAAR1 (0.50) TAAR1ALDH1A1KDM4EMEN1MAPT
SCHEMBL6983619 0.79 MAPT (0.46) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL8175589 0.78 KDM4E (0.48) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL6141027 0.78 ADRB2 (0.42) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL29957257 0.77 LMNA (0.48) ALDH1A1MEN1KMT2ATSHR
SCHEMBL3150352 0.77 LMNA (0.48) ALDH1A1MEN1KMT2ATSHR
SCHEMBL6128189 0.75 SLC6A4 (0.41) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL3221593 0.75 MEN1 (0.44) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL7379036 0.74 TAAR1 (0.41) TAAR1ALDH1A1MEN1KMT2ATSHR

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
US-20060052600-A1 Amino-functional chalcones LICA PHARMACEUTICALS A/S (DK) 2006-03-09 US disclosed