SCHEMBL7277463

SCHEMBL7277463

CCCc1[nH]cnc1CN(C)C(=O)c1cn(C)c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 3/20 0.54
HTR3E A5X5Y0 2/20 0.54
HTR3B O95264 2/20 0.54
HTR3D Q70Z44 2/20 0.54
HTR3C Q8WXA8 2/20 0.54
ADRA2A P08913 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
SLC6A4 P31645 1/20 0.44
OPRK1 P41145 1/20 0.44
HTR2B P41595 1/20 0.44
KCNH2 Q12809 1/20 0.44
LMNA P02545 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MITF O75030 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NR4A2 P43354 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL7267047 0.86 HTR3A (0.66) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL7316274 0.82 HTR3A (0.76) HTR3AHTR3EHTR3BHTR3DHTR3C
Fumaric Acid SCHEMBL7312911 0.77 HTR3A (0.68) HTR3AHTR3EHTR3BHTR3DHTR3C
Maleic Acid SCHEMBL7312902 0.77 HTR3A (0.68) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL27249697 0.75 LMNA (0.57) LMNAALDH1A1MITFMAPTKMT2A
SCHEMBL27249469 0.73 LMNA (0.50) LMNAALDH1A1MITFMAPTKMT2A
SCHEMBL7267311 0.73 HTR3A (0.62) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL29334973 0.71 LMNA (0.55) LMNAALDH1A1MITFMAPTKMT2A
SCHEMBL27249475 0.71 LMNA (0.55) LMNAALDH1A1MITFMAPTKMT2A
SCHEMBL29399763 0.70 HTR3A (1.00) HTR3AHTR3EHTR3BHTR3DHTR3C

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-5026722-A Antagonists of 5-hydroxytryptamine GLAXO GROUP LIMITED (GB) 1991-06-25 US disclosed
EP-0347229-A1 Indole derivatives GLAXO GROUP LIMITED (GB) 1989-12-20 EP disclosed