SCHEMBL6570156

SCHEMBL6570156

C#CC(CCCc1ccc(Cl)cc1)N1CCC(C)CC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 13/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAOB P27338 1/20 0.40
HRH3 Q9Y5N1 4/20 0.38

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
SCHEMBL6570100 0.87 SIGMAR1 (0.51) SIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL6569758 0.84 HRH3 (0.45) SIGMAR1NPC1RAB9ASMN1; SMN2MAOB
SCHEMBL6570120 0.73 L3MBTL1 (0.47) SIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL6052744 0.72 SIGMAR1 (0.44) SIGMAR1NPC1RAB9ASMN1; SMN2HRH3
SCHEMBL6570161 0.68 MAOB (0.48) SIGMAR1NPC1RAB9ASMN1; SMN2MAOB
SCHEMBL17828185 0.68 HRH3 (0.75) SIGMAR1HRH3
SCHEMBL6570152 0.68 SIGMAR1 (0.43) SIGMAR1NPC1RAB9ASMN1; SMN2HRH3
SCHEMBL491791 0.67 HRH3 (0.72) SIGMAR1HRH3
SCHEMBL156202 0.66 HRH3 (0.76) SIGMAR1RAB9AHRH3
SCHEMBL19705213 0.64 TEAD1 (0.39) 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-1100503-B1 NON-IMIDAZOLE ALKYLAMINES AS HISTAMINE H 3?-RECEPTOR LIGANDS AND THEIR THERAPEUTIC APPLICATIONS ILE BIOPROJET SOC CIV (FR) 2004-09-22 EP claimed