SCHEMBL8971073

SCHEMBL8971073

CC1CCN(CCCCC=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.46
CARM1 Q86X55 1/20 0.46
PRMT6 Q96LA8 1/20 0.46
PRMT1 Q99873 1/20 0.46
PRMT8 Q9NR22 1/20 0.46
KDM4E B2RXH2 1/20 0.43
RECQL P46063 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
HRH3 Q9Y5N1 5/20 0.42
KMT2A Q03164 2/20 0.41
HTR7 P34969 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.41
CHRM2 P08172 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
DRD1 P21728 1/20 0.41

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
SCHEMBL5808106 0.94 SIGMAR1 (0.50) SIGMAR1CARM1PRMT6PRMT1PRMT8
SCHEMBL15535655 0.89 SIGMAR1 (0.40) SIGMAR1HRH3HTR7
SCHEMBL2560880 0.86 CARM1 (0.50) SIGMAR1CARM1PRMT6PRMT1PRMT8
SCHEMBL7285791 0.81 GNAI3 (0.55) HRH3
SCHEMBL8971344 0.81 KCNA3 (0.38) SIGMAR1HRH3
SCHEMBL8970839 0.80 BCHE (0.35) HRH3KMT2ALMNACHRM2
SCHEMBL7284092 0.79 GNAO1 (0.58) SIGMAR1HRH3
SCHEMBL7293980 0.79 GNAO1 (0.58) SIGMAR1HRH3
SCHEMBL7291145 0.79 GNAO1 (0.58) SIGMAR1HRH3
SCHEMBL7293988 0.79 GNAO1 (0.58) SIGMAR1HRH3

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-0700383-A1 NOVEL 1-PHENYLALKANONE 5-HT 4? RECEPTOR LIGANDS SYNTEX (U.S.A.) INC. (US) 1996-03-13 EP disclosed