SCHEMBL6570152

SCHEMBL6570152

C#CC(C(CC)c1ccc(Cl)cc1)N1CCC(C)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 13/20 0.43
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
MITF O75030 1/20 0.38
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
HSD11B1 P28845 1/20 0.36
HRH3 Q9Y5N1 2/20 0.35

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
SCHEMBL6570097 0.86 SIGMAR1 (0.43) SIGMAR1KMT2AMEN1ALDH1A1MAPT
SCHEMBL6569755 0.85 TP53 (0.40) KMT2AMEN1MITFLMNASMN1; SMN2
SCHEMBL6570156 0.68 SIGMAR1 (0.43) SIGMAR1SMN1; SMN2NPC1RAB9AHRH3
SCHEMBL18848916 0.64 SIGMAR1 (0.48) SIGMAR1
SCHEMBL12157071 0.62 ADRB2 (0.48) KMT2AMEN1MITFLMNASMN1; SMN2
SCHEMBL17084112 0.62 ADRB2 (0.48) KMT2AMEN1MITFLMNASMN1; SMN2
SCHEMBL25447405 0.61 ADRB2 (0.46) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL156202 0.60 HRH3 (0.76) SIGMAR1KMT2AMEN1MITFRAB9A
SCHEMBL12120376 0.60 FPR2 (0.48) SIGMAR1HRH3
SCHEMBL156934 0.60 USP2 (0.58) SIGMAR1KMT2AMEN1LMNASMN1; SMN2

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