SCHEMBL6817248

SCHEMBL6817248

C1CCC2NCCCCN2CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.39
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CYP2D6 P10635 5/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
CHRM5 P08912 2/20 0.32
ADRA2C P18825 2/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
TSHR P16473 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MLNR O43193 1/20 0.32
ABCB11 O95342 1/20 0.32
EGFR P00533 1/20 0.32
FYN P06241 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
HTR1A P08908 1/20 0.32
ADRA2A P08913 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
SCHEMBL5241137 1.00 HTR6 (0.39) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL616084 1.00 HTR6 (0.39) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL4023649 1.00 HTR6 (0.39) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL1181468 0.98 HTR6 (0.40) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL22628194 0.98 HTR6 (0.40) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL548524 0.95 HTR6 (0.39) HTR6MEN1KMT2ACYP2D6ALDH1A1
SCHEMBL9632289 0.93 KDM4E (0.38) HTR6MEN1KMT2AALDH1A1KDM4E
SCHEMBL28210606 0.93 MEN1 (0.36) HTR6MEN1KMT2AALDH1A1KDM4E
SCHEMBL1202752 0.93 MEN1 (0.36) HTR6MEN1KMT2AALDH1A1KDM4E
SCHEMBL9388849 0.93 HTR6 (0.40) HTR6MEN1KMT2ACYP2D6ALDH1A1

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-1083881-B1 LIPOSOME COMPOSITIONs containing a quinolone derivative AND their use as antibacterial agents ALZA CORP (US) 2004-08-25 EP disclosed
EP-1176962-B1 LIPOSOME COMPOSITIONS FOR IMPROVED DRUG RETENTION ALZA CORP (US) 2004-02-11 EP disclosed