SCHEMBL7433696

SCHEMBL7433696

OCC1(CN2CCCCC2)CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TSHR P16473 2/20 0.33
MAPT P10636 3/20 0.32
ATM Q13315 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
GAA P10253 2/20 0.32
ALDH1A1 P00352 3/20 0.31
POLB P06746 2/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL22725302 0.93 MAPT (0.33) MEN1KMT2ATSHRMAPTATM
SCHEMBL22725319 0.93 MEN1 (0.36) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL951043 0.91 MAPT (0.34) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL18761051 0.86 KDM1A (0.36) MAPTATMGAA
SCHEMBL17066768 0.77 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3MEN1KMT2A
SCHEMBL25642348 0.77 KDM4E (0.41) SLC6A2SLC6A4SLC6A3TSHRGAA
SCHEMBL7442901 0.74 ADRA2A (0.48) MEN1KMT2ATSHRMAPTALDH1A1
SCHEMBL4874234 0.74 ALDH1A1 (0.39) TSHRMAPTALDH1A1
SCHEMBL22444527 0.74 ALDH1A1 (0.39) TSHRMAPTALDH1A1
SCHEMBL2022361 0.74 ALDH1A1 (0.39) TSHRMAPTALDH1A1

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-0479665-A2 1,4-Dihydropyridine derivatives, method for preparing the same and use thereof TEIKOKU CHEMICAL INDUSTRIES CO., LTD. (JP) 1992-04-08 EP disclosed