SCHEMBL20758015

SCHEMBL20758015

CC1CCN(C2CCCNC2)C1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.48
ARG1 P05089 1/20 0.33
ARG2 P78540 1/20 0.33
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 1/20 0.31
HTR2B P41595 1/20 0.31
HTR3A P46098 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31
HTR3D Q70Z44 1/20 0.31
HTR3C Q8WXA8 1/20 0.31
TLR9 Q9NR96 1/20 0.30
TLR8 Q9NR97 1/20 0.30
TLR7 Q9NYK1 1/20 0.30

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
SCHEMBL20757858 1.00 HTR6 (0.48) HTR6ARG1ARG2HTR3EHTR3B
SCHEMBL18082909 0.91 HTR6 (0.52) HTR6ARG1ARG2HTR3EHTR3B
SCHEMBL12534 0.91 HTR6 (0.52) HTR6ARG1ARG2HTR3EHTR3B
SCHEMBL12533 0.91 HTR6 (0.52) HTR6ARG1ARG2HTR3EHTR3B
SCHEMBL23588777 0.89 HTR6 (0.42) HTR6ARG1ARG2
SCHEMBL5228670 0.89 HTR6 (0.57) HTR6ARG1ARG2HTR3EHTR3B
SCHEMBL27046822 0.89 HTR6 (0.42) HTR6ARG1ARG2
SCHEMBL23588776 0.89 HTR6 (0.42) HTR6ARG1ARG2
Hydrochloric Acid SCHEMBL31015226 0.87 HTR6 (0.55) HTR6ARG1ARG2HTR3EHTR3B
SCHEMBL24185129 0.85 HTR6 (0.53) HTR6HTR3EHTR3BHTR2BHTR3A

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
WO-2019034890-A1 PYRROLO[2,3-B]PYRIDINE COMPOUNDS AND THEIR USE IN THE TREATMENT OF CANCER CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-02-21 WO disclosed