SCHEMBL27604341

SCHEMBL27604341

Ic1ccn([C@H]2CCCNC2)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.36
HTR2B P41595 2/20 0.36
HTR3E A5X5Y0 1/20 0.36
HTR3B O95264 1/20 0.36
HTR3A P46098 1/20 0.36
TMEM97 Q5BJF2 1/20 0.36
HTR3D Q70Z44 1/20 0.36
HTR3C Q8WXA8 1/20 0.36
BRAF P15056 1/20 0.34
PIM1 P11309 2/20 0.34
PIM2 Q9P1W9 2/20 0.34
KCNH2 Q12809 1/20 0.34
PIM3 Q86V86 1/20 0.34
RPS6KA5 O75582 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
HTR6 P50406 3/20 0.33
PRKCI P41743 1/20 0.32
PARP1 P09874 1/20 0.32
HTR2A P28223 1/20 0.32

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
SCHEMBL27604342 1.00 TLR8 (0.36) TLR8HTR2BHTR3EHTR3BHTR3A
SCHEMBL19471825 1.00 TLR8 (0.36) TLR8HTR2BHTR3EHTR3BHTR3A
SCHEMBL29063640 0.90 MEN1 (0.33) HTR2BPIM1HTR6HTR2AHTR2C
SCHEMBL5823183 0.90 MEN1 (0.33) HTR2BPIM1HTR6HTR2AHTR2C
SCHEMBL27604403 0.83
SCHEMBL26101147 0.81 SIGMAR1 (0.36) SIGMAR1
SCHEMBL27568268 0.81 SIGMAR1 (0.39) KCNH2SIGMAR1
SCHEMBL23418737 0.81 TLR8 (0.41) TLR8HTR2BHTR3EHTR3BHTR3A
SCHEMBL5801953 0.80 MEN1 (0.39) TLR8PIM1HTR2AHTR2C
SCHEMBL29341832 0.78 TLR8 (0.37) TLR8HTR2BHTR3EHTR3BHTR3A

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
CN-101426792-A Pyrazolopyrimidines as therapeutic agents ABBOTT GMBH & CO KG (DE) 2009-05-06 CN disclosed
CN-1520298-A Pyrazolopyrimidines as therapeutic agents �����ʩ���عɷݹ�˾ 2004-08-11 CN disclosed