SCHEMBL7284353

SCHEMBL7284353

Cc1cn(CCC(=O)c2cn(C)c3ccccc23)cn1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3E A5X5Y0 1/20 0.60
HTR3B O95264 1/20 0.60
HTR3A P46098 1/20 0.60
HTR3D Q70Z44 1/20 0.60
HTR3C Q8WXA8 1/20 0.60
LMNA P02545 2/20 0.56
KMT2A Q03164 2/20 0.56
ALDH1A1 P00352 2/20 0.56
MITF O75030 1/20 0.56
MAPT P10636 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
NR4A2 P43354 1/20 0.47
POLB P06746 1/20 0.47
HTT P42858 1/20 0.46
QPCT Q16769 1/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
TSHR P16473 1/20 0.42

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
Hydrochloric Acid SCHEMBL7276513 0.99 HTR3E (0.58) HTR3EHTR3BHTR3AHTR3DHTR3C
Hydrochloric Acid SCHEMBL7284592 0.84 LMNA (0.52) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL7278144 0.80 LMNA (0.56) HTR3EHTR3BHTR3AHTR3DHTR3C
Hydrochloric Acid SCHEMBL7278175 0.78 HTR3E (0.55) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL14745414 0.78 LMNA (0.71) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL7275417 0.77 HTR3E (0.56) HTR3EHTR3BHTR3AHTR3DHTR3C
Hydrochloric Acid SCHEMBL7285142 0.76 HTR3E (0.55) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL11227116 0.76 LMNA (0.68) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL8757189 0.75 HTR3E (0.62) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL29399763 0.75 HTR3A (1.00) HTR3EHTR3BHTR3AHTR3DHTR3C

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
EP-0266899-A2 Indole derivatives GLAXO GROUP LIMITED (GB) 1988-05-11 EP claimed
US-4814344-A ANTIEMENTICS, ANTIPSYCHOTICS GLAXO GROUP LIMITED 1989-03-21 US disclosed