SCHEMBL1471529

SCHEMBL1471529

CC(C)Oc1ccccc1OCCNCc1cccc(N2CCCCC2)c1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 7/20 0.64
PRMT6 Q96LA8 1/20 0.51
HTR6 P50406 3/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 2/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ADRA1D P25100 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
KDM4E B2RXH2 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TRPA1 O75762 1/20 0.41
AGXT P21549 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
Formaldehyde SCHEMBL1470985 0.81 PRMT6 (0.46) HTR1APRMT6ADRA1DADRA1AADRA1B
SCHEMBL1473252 0.81 HTR1A (0.59) HTR1ALMNAMAPTHTTKMT2A
SCHEMBL1470711 0.78 HTR1A (0.58) HTR1ALMNAMAPTHTTKMT2A
SCHEMBL7700763 0.77 HTR1A (0.70) HTR1AHTR6LMNAALDH1A1MAPT
SCHEMBL5647829 0.76 HTR1A (0.70) HTR1AHTR6LMNAADRA1DADRA1A
SCHEMBL6566542 0.76 HTR1A (0.71) HTR1ALMNAALDH1A1ADRA1DADRA1A
SCHEMBL1471527 0.73 HTR1A (0.75) HTR1AHTR6LMNAADRA1DADRA1A
SCHEMBL1471422 0.72 PRMT6 (0.53) PRMT6HTR6ALDH1A1MAPTHTT
SCHEMBL7704520 0.71 HTR1A (0.61) HTR1AHTR6LMNAADRA1DADRA1A
SCHEMBL6565663 0.70 HTR1A (0.63) HTR1ALMNAALDH1A1MAPTKMT2A

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
US-7915420-B2 Aryl piperidine amides JANSSEN PHARMACEUTICA NV (BE) 2011-03-29 US disclosed