SCHEMBL6570100

SCHEMBL6570100

C#CC(CCCc1ccccc1)N1CCC(C)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 4/20 0.51
ACHE P22303 2/20 0.49
ALDH1A1 P00352 2/20 0.44
USP2 O75604 1/20 0.44
GAA P10253 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
MC4R P32245 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL6570156 0.87 SIGMAR1 (0.43) SIGMAR1NPC1RAB9ASMN1; SMN2
SCHEMBL6570120 0.86 L3MBTL1 (0.47) SIGMAR1ACHEALDH1A1USP2GAA
SCHEMBL5713440 0.75 SIGMAR1 (0.50) SIGMAR1ACHEALDH1A1USP2GAA
SCHEMBL13504052 0.70 SIGMAR1 (0.88) SIGMAR1ACHEALDH1A1USP2
SCHEMBL6569758 0.69 HRH3 (0.45) SIGMAR1ALDH1A1GAANPC1RAB9A
SCHEMBL11197419 0.69 SIGMAR1 (0.68) SIGMAR1ACHEALDH1A1USP2
SCHEMBL17285905 0.69 SIGMAR1 (0.97) SIGMAR1ACHEALDH1A1USP2
SCHEMBL22636376 0.68 SIGMAR1 (0.43) SIGMAR1L3MBTL1
SCHEMBL6570105 0.67 SIGMAR1 (0.61) SIGMAR1ACHEALDH1A1USP2NPC1
SCHEMBL152736 0.66 ACHE (1.00) SIGMAR1ACHEALDH1A1USP2

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