SCHEMBL11468794

SCHEMBL11468794

CN[C@@H]1CCCCC[C@H]1Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
HTT P42858 2/20 0.46
MAPT P10636 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALOX12 P18054 1/20 0.46
TRPA1 O75762 1/20 0.44
TAS1R3 Q7RTX0 1/20 0.40
TAS1R2 Q8TE23 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
IKZF2 Q9UKS7 1/20 0.40
CYP2D6 P10635 5/20 0.39
SLC6A2 P23975 4/20 0.39
SLC6A4 P31645 4/20 0.39
SLC6A3 Q01959 4/20 0.39
CYP2C9 P11712 1/20 0.39
ADORA3 P0DMS8 2/20 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
SCHEMBL11468793 1.00 LMNA (0.46) LMNAMEN1KMT2AHTTMAPT
SCHEMBL11447011 0.95 TRPA1 (0.42) LMNAMEN1KMT2AHTTMAPT
SCHEMBL11447010 0.95 TRPA1 (0.42) LMNAMEN1KMT2AHTTMAPT
SCHEMBL11334450 0.81 MAPT (0.41) LMNAMEN1KMT2AHTTMAPT
SCHEMBL11334447 0.81 MAPT (0.41) LMNAMEN1KMT2AHTTMAPT
SCHEMBL11334977 0.81 SLC6A4 (0.51) LMNAMEN1KMT2AHTTMAPT
SCHEMBL11480574 0.81 MEN1 (0.46) LMNAMEN1KMT2AHTTMAPT
SCHEMBL11334975 0.81 SLC6A4 (0.51) LMNAMEN1KMT2AHTTMAPT
SCHEMBL11480572 0.81 MEN1 (0.46) LMNAMEN1KMT2AHTTMAPT
SCHEMBL11479971 0.80 SIGMAR1 (0.45) LMNAMEN1KMT2AHTTMAPT

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
US-4199589-A N-(2-Aminocycloheptyl)acylanilides and methods to treat depression SZMUSZKOVICZ JACOB (US) 1980-04-22 US disclosed
US-4172898-A N-(2-aminocycloheptyl)acylanilides THE UPJOHN COMPANY (US) 1979-10-30 US disclosed
US-4159339-A ANTIDEPRESSANTS THE UPJOHN COMPANY (US) 1979-06-26 US disclosed
US-4156014-A N-(2-aminocycloheptyl)alkanoylanilides and in the treatment of depression THE UPJOHN COMPANY (US) 1979-05-22 US disclosed