SCHEMBL7797793

SCHEMBL7797793

Nc1ccc(C2CC2C=O)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
CYP19A1 P11511 2/20 0.35
KDM1A O60341 9/20 0.33
MAOB P27338 3/20 0.33
KCNH2 Q12809 2/20 0.33
RCOR1 Q9UKL0 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM1B Q8NB78 1/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 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
SCHEMBL3901979 0.81 HTR2A (0.46) HTR2AHTR2CHTR2B
SCHEMBL2360390 0.79 KDM1A (0.52) KDM1AHTR2AHTR2CHTR2B
SCHEMBL11965121 0.79 HTR2A (0.44) HTR2AHTR2CHTR2BALDH1A1
SCHEMBL2324658 0.79 KDM1A (0.52) KDM1AMAOBKCNH2RCOR1MEN1
SCHEMBL6250772 0.79 KDM1A (0.47) KDM1AMEN1MAPTKMT2AALDH1A1
SCHEMBL2359931 0.79 HTR2A (0.44) HTR2AHTR2CHTR2BALDH1A1
SCHEMBL2854689 0.79 KDM1A (0.52) KDM1AMAOBKCNH2RCOR1MEN1
SCHEMBL2827719 0.79 KDM1A (0.52) KDM1AMAOBKCNH2RCOR1MEN1
SCHEMBL446481 0.78 MAOB (0.48) KDM1AMAOBKCNH2RCOR1MAPT
SCHEMBL446482 0.78 MAOB (0.48) KDM1AMAOBKCNH2RCOR1MAPT

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-0849262-B1 Aminophenyl ketone derivatives and a method for the preparation thereof AMERICAN CYANAMID CO (US) 2001-10-17 EP claimed