SCHEMBL10901424

SCHEMBL10901424

CN1CCC(c2occ3cc(C4CCCCC4)ccc23)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
QDPR P09417 2/20 0.44
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
HTR6 P50406 3/20 0.38
SLC6A4 P31645 2/20 0.37
KCNH2 Q12809 2/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A3 Q01959 1/20 0.37
DRD2 P14416 1/20 0.36
BACE1 P56817 1/20 0.36
TLR9 Q9NR96 1/20 0.35
TLR8 Q9NR97 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
HRH3 Q9Y5N1 3/20 0.35
CLK1 P49759 1/20 0.34
CLK2 P49760 1/20 0.34
DYRK1A Q13627 1/20 0.34
HIPK1 Q86Z02 1/20 0.34
HIPK2 Q9H2X6 1/20 0.34
HIPK3 Q9H422 1/20 0.34

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
SCHEMBL10901806 0.83 TLR9 (0.41) SLC6A4DRD2TLR9TLR8TLR7
SCHEMBL10901664 0.81 QDPR (0.42) QDPRSLC6A4KCNH2SLC6A2SLC6A3
SCHEMBL10901490 0.81 MAOB (0.40) SLC6A4DRD2BACE1TLR7
SCHEMBL10898362 0.81 ABL1 (0.41) QDPRTLR9TLR8TLR7
SCHEMBL10902493 0.81 CHRM2 (0.37) QDPRHTR6HRH4
SCHEMBL2721295 0.80 HRH4 (0.40) DRD2HRH3LSSHRH4
SCHEMBL10899853 0.80 KDM4E (0.39) QDPRHRH3HRH4
SCHEMBL10902920 0.80 DRD2 (0.40) SLC6A4DRD2
SCHEMBL10901727 0.77 FDFT1 (0.42) QDPRHTR6DRD2DRD3
SCHEMBL10902802 0.77 ACSS2 (0.32) QDPRSLC6A4SLC6A2SLC6A3HRH3

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
US-4600719-A Tetrahydropyridine and piperidine derivatives CIBA GEIGY CORPORATION (US) 1986-07-15 US disclosed
US-4210655-A Anti-depressant benzofuranyl piperidines CIBA-GEIGY CORPORATION (US) 1980-07-01 US disclosed