SCHEMBL5773815

SCHEMBL5773815

COc1cccc2c([C@@H](O)CN3CCC(NCc4sc5ccccc5c4Cl)CC3)ccnc12

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 12/20 0.45
KCNH2 Q12809 2/20 0.44
SIGMAR1 Q99720 1/20 0.40
HTR1A P08908 3/20 0.39
SLC6A4 P31645 2/20 0.39
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
BACE1 P56817 1/20 0.37

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
SCHEMBL4272893 0.85 KCNH2 (0.62) SLC2A1KCNH2
SCHEMBL5773652 0.84 SLC2A1 (0.47) SLC2A1KCNH2SIGMAR1
SCHEMBL5777366 0.81 LMNA (0.47) SLC2A1KCNH2SIGMAR1KMT2A
SCHEMBL5775396 0.80 KCNH2 (0.49) SLC2A1KCNH2SIGMAR1HTR1A
SCHEMBL5772116 0.79 SLC2A1 (0.48) SLC2A1KCNH2SIGMAR1HTR1ASLC6A4
SCHEMBL5776996 0.79 SLC2A1 (0.54) SLC2A1KCNH2HTR1A
SCHEMBL5775045 0.79 KCNH2 (0.52) SLC2A1KCNH2SIGMAR1
SCHEMBL5778699 0.78 SLC2A1 (0.58) SLC2A1KCNH2SIGMAR1HTR1ASLC6A4
SCHEMBL5772802 0.78 SLC2A1 (0.48) SLC2A1KCNH2SIGMAR1MEN1KMT2A
SCHEMBL5777778 0.78 SLC2A1 (0.47) SLC2A1KCNH2SIGMAR1HTR1ASLC6A4

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-1305308-B1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 2006-12-20 EP claimed