SCHEMBL4676098

SCHEMBL4676098

NC[CH]CN1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.36
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CARM1 Q86X55 1/20 0.32
PRMT6 Q96LA8 1/20 0.32
PRMT8 Q9NR22 1/20 0.32
CHRM5 P08912 1/20 0.32
ADRA2C P18825 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPT P10636 1/20 0.31
ANPEP P15144 1/20 0.30
ERAP2 Q6P179 1/20 0.30
TSHR P16473 1/20 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
SCHEMBL1400000 0.83 HRH3 (0.43) HRH3CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL27687298 0.75 SMN1; SMN2 (0.46) HRH3MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL27706582 0.75 ALOX15 (0.36) LMNAPRMT6
SCHEMBL10378784 0.74 CARM1 (0.37) HRH3CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL9412671 0.73 HRH3 (0.32) HRH3SMN1; SMN2
SCHEMBL23872301 0.71 HRH3 (0.43) HRH3CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL10748748 0.71 HRH3 (0.43) HRH3CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL7227482 0.71 HRH3 (0.43) HRH3CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL21629978 0.70
SCHEMBL10756863 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1416933-B8 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEN INC (US) 2008-08-27 EP disclosed
EP-1416933-A1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR Amgem, Inc. (US) 2004-05-12 EP disclosed
WO-2003009847-A1 SUBSTITUTED PIPERIDINES AS MODULATORS OF THE MELANOCORTIN RECEPTOR AMGEM, INC. (US) 2003-02-06 WO disclosed