SCHEMBL26029903

SCHEMBL26029903

CC1CC(N2CCN(C3CCN(C(C)C)CC3)CC2)C1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.37
L3MBTL3 Q96JM7 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MBTD1 Q05BQ5 1/20 0.33
KDM1A O60341 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
TLR9 Q9NR96 2/20 0.32
TLR8 Q9NR97 2/20 0.32
TLR7 Q9NYK1 2/20 0.32
VCP P55072 1/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL14453902 0.87 HRH3 (0.41) HRH3L3MBTL3L3MBTL1MBTD1TLR9
SCHEMBL22456342 0.87 HRH3 (0.41) HRH3L3MBTL3L3MBTL1MBTD1TLR9
SCHEMBL23384368 0.85 KDM4E (0.42) HRH3L3MBTL3L3MBTL1MBTD1KDM4E
SCHEMBL13744835 0.85 KDM4E (0.42) HRH3L3MBTL3L3MBTL1MBTD1KDM4E
SCHEMBL23384260 0.85 HRH3 (0.40) HRH3L3MBTL3L3MBTL1MBTD1TLR9
SCHEMBL24726517 0.85 HRH3 (0.40) HRH3L3MBTL3L3MBTL1MBTD1TLR9
SCHEMBL22456382 0.83 HRH3 (0.49) HRH3L3MBTL3L3MBTL1MBTD1
SCHEMBL24828016 0.82 HRH3 (0.33) HRH3L3MBTL3L3MBTL1MBTD1KDM4E
SCHEMBL22456360 0.81 L3MBTL3 (0.42) HRH3L3MBTL3L3MBTL1MBTD1
SCHEMBL22175014 0.81 KDM4E (0.43) HRH3KDM4EALDH1A1ALOX15

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
EP-3640248-B1 AMINOPYRIMIDINE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF BEIJING ADAMADLE BIOTECHNOLOGY LLC (CN) 2023-08-23 EP disclosed