SCHEMBL11447010

SCHEMBL11447010

CNC1CCCC1Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.42
LMNA P02545 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HTT P42858 2/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
ALOX12 P18054 1/20 0.40
CYP2D6 P10635 4/20 0.40
SLC6A2 P23975 4/20 0.40
SLC6A4 P31645 4/20 0.40
SLC6A3 Q01959 4/20 0.40
CYP2C9 P11712 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
FPR2 P25090 1/20 0.38
PROKR1 Q8TCW9 1/20 0.38
IKZF2 Q9UKS7 1/20 0.38
ALDH1A1 P00352 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
SCHEMBL11447011 1.00 TRPA1 (0.42) TRPA1LMNASMN1; SMN2HTTMEN1
SCHEMBL11468793 0.95 LMNA (0.46) TRPA1LMNASMN1; SMN2HTTMEN1
SCHEMBL11468794 0.95 LMNA (0.46) TRPA1LMNASMN1; SMN2HTTMEN1
SCHEMBL11570582 0.80 SSTR3 (0.38) TRPA1LMNASMN1; SMN2HTTMEN1
SCHEMBL11570584 0.80 SSTR3 (0.38) TRPA1LMNASMN1; SMN2HTTMEN1
SCHEMBL11450448 0.80 SLC6A4 (0.49) TRPA1LMNASMN1; SMN2HTTMEN1
SCHEMBL11446427 0.80 TRPA1 (0.42) TRPA1LMNASMN1; SMN2HTTMEN1
SCHEMBL11446423 0.80 TRPA1 (0.42) TRPA1LMNASMN1; SMN2HTTMEN1
SCHEMBL11443800 0.80 SLC6A4 (0.49) TRPA1LMNASMN1; SMN2HTTMEN1
SCHEMBL11443799 0.80 SLC6A4 (0.49) TRPA1LMNASMN1; SMN2HTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4204003-A N-(2-Aminocyclopentyl)-N-alkanoylanilides as CNS anti-depressants THE UPJOHN COMPANY (US) 1980-05-20 US disclosed
US-4156015-A N-(2-Aminocyclopentyl)acylanilides and treating depression THE UPJOHN COMPANY (US) 1979-05-22 US disclosed