SCHEMBL6138220

SCHEMBL6138220

CN(C)C1(CCc2cccnc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.57
CHRNB2 P17787 2/20 0.51
CHRNA4 P43681 2/20 0.51
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
OPRM1 P35372 1/20 0.47
OPRL1 P41146 1/20 0.47
CYP2A6 P11509 1/20 0.46
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HRH1 P35367 2/20 0.44

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
Hydrochloric Acid SCHEMBL6138304 0.98 CHRNA7 (0.56) CHRNA7CHRNB2CHRNA4TDP1L3MBTL1
SCHEMBL6138067 0.84 CHRNA7 (0.48) CHRNA7CHRNB2CHRNA4TDP1L3MBTL1
SCHEMBL7610378 0.78 RIPK1 (0.42) CHRNA7CHRNB2CHRNA4
SCHEMBL6138336 0.76 CHRM2 (0.49) CHRNA7CHRNB2CHRNA4OPRM1OPRL1
SCHEMBL6138221 0.75 CHRNA7 (0.47) CHRNA7CHRNB2CHRNA4TDP1L3MBTL1
Hydrochloric Acid SCHEMBL6290150 0.75 CHRM2 (0.48) CHRNA7CHRNB2CHRNA4OPRM1OPRL1
Hydrochloric Acid SCHEMBL6138577 0.74 CHRNA7 (0.46) CHRNA7CHRNB2CHRNA4TDP1L3MBTL1
SCHEMBL724866 0.73 CHRNA7 (0.74) CHRNA7CHRNB2CHRNA4TDP1L3MBTL1
SCHEMBL29485692 0.73 CHRNA7 (0.74) CHRNA7CHRNB2CHRNA4TDP1L3MBTL1
SCHEMBL6137939 0.73 CHRNB2 (0.60) CHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1170281-B1 1,1- and 1,2-disubstituted cyclopropanes, process for their preparation and pharmaceutical compositions thereof SERVIER LAB (FR) 2005-12-21 EP claimed
EP-1170281-A1 1,1- and 1,2-disubstituted cyclopropanes, process for their preparation and pharmaceutical compositions thereof LES LABORATOIRES SERVIER (FR) 2002-01-09 EP claimed
EP-1170281-B1 1,1- and 1,2-disubstituted cyclopropanes, process for their preparation and pharmaceutical compositions thereof SERVIER LAB (FR) 2005-12-21 EP disclosed
EP-1170281-A1 1,1- and 1,2-disubstituted cyclopropanes, process for their preparation and pharmaceutical compositions thereof LES LABORATOIRES SERVIER (FR) 2002-01-09 EP disclosed