SCHEMBL6935830

SCHEMBL6935830

C1=C2CCCNCC2CCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
GABRA2 P47869 1/20 0.39
GABRB2 P47870 1/20 0.39
GABRA4 P48169 1/20 0.39
GABRE P78334 1/20 0.39
GABRA6 Q16445 1/20 0.39
GABRG1 Q8N1C3 1/20 0.39
GABRG3 Q99928 1/20 0.39
GABRQ Q9UN88 1/20 0.39
CYP2D6 P10635 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38

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
Bromide SCHEMBL11270772 0.89 KDM1A (0.39) CYP2D6SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL6083553 0.86 HTR3A (0.44) HTR3AHTR2AHTR2C
SCHEMBL6120653 0.85 CYP2D6 (0.38) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL571897 0.78
SCHEMBL5807021 0.78
SCHEMBL14741159 0.78
SCHEMBL32689488 0.78
SCHEMBL6856181 0.77
SCHEMBL121088 0.77
Hydrochloric Acid SCHEMBL9391692 0.76 KDM1A (0.31)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1370567-A2 METHOD FOR THE PRODUCTION OF PENTOPYRANOSYL NUCLEOSIDES Nanogen Recognomics GmbH (DE) 2003-12-17 EP claimed
WO-2002072595-A2 METHOD FOR THE PRODUCTION OF PENTOPYRANOSYL NUCLEOSIDES NANOGEN RECOGNOMICS GMBH (DE) 2002-09-19 WO claimed
EP-0575507-A1 PROCESS FOR RECYCLING AMINE ISOMER. PFIZER (US) 1993-12-29 EP disclosed
WO-1992015552-A1 PROCESS FOR RECYCLING AMINE ISOMER PFIZER INC. (US) 1992-09-17 WO disclosed