SCHEMBL6839874

SCHEMBL6839874

[C]#CCCC1=CCc2ccccc2O1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
GAA P10253 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31

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
SCHEMBL295013 0.78 MAOA (0.41) MAOAMAOBGAANPSR1
SCHEMBL10645704 0.78 MAOA (0.41) MAOAMAOBGAANPSR1
SCHEMBL9773035 0.78 MAOA (0.41) MAOAMAOBGAANPSR1
SCHEMBL7217002 0.75 MAOA (0.45) MAOAMAOBGAANPSR1
SCHEMBL294713 0.75 MAOA (0.38) MAOAMAOBGAANPSR1
SCHEMBL10350240 0.75 MAOA (0.38) MAOAMAOBGAANPSR1
SCHEMBL292650 0.74 MAOA (0.37) MAOAMAOBGAANPSR1
SCHEMBL27731586 0.74 MAOA (0.37) MAOAMAOB
SCHEMBL4206535 0.74 MAOA (0.43) MAOAMAOBGAANPSR1
SCHEMBL3626527 0.74 MAOA (0.43) MAOAMAOBGAANPSR1

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
US-6762168-B2 ANTIBACTERIAL COMPOUNDS. THE INVENTION CONCERNS MACROLIDE ANTIBIOTICS USEFUL AS ANTIINFECTIVE AGENTS. KOSAN BIOSCIENCES, INC. 2004-07-13 US disclosed