SCHEMBL3798154

SCHEMBL3798154

O=c1nc(NCCS)cc[nH]1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.32
HRH4 Q9H3N8 1/20 0.32

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
SCHEMBL4113139 0.81 ELANE (0.43) ALDH1A1
SCHEMBL3219798 0.81 ALDH1A1 (0.35) ALDH1A1POLBHRH4
SCHEMBL3680113 0.81 POLB (0.41) ALDH1A1POLB
SCHEMBL6379848 0.81 ZAP70 (0.39) ALDH1A1HRH4
SCHEMBL10899344 0.80 ALDH1A1 (0.31) ALDH1A1POLBHRH4
SCHEMBL3407144 0.79 HRH3 (0.50) ALDH1A1HRH4
SCHEMBL29509040 0.79 TLR8 (0.49) ALDH1A1
SCHEMBL606375 0.77 ELANE (0.46)
SCHEMBL8840758 0.77 HRH3 (0.45) ALDH1A1HRH4
SCHEMBL29509020 0.77 HCAR3 (0.43) ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010042514-A1 NANOPORE AND CARBON NANOTUBE BASED DNA SEQUENCER AND A SERIAL RECOGNITION ELEMENTS ARIZONA BOARD OF REGENTS (US) 2010-04-15 WO disclosed
WO-2008124706-A9 DEVICES AND METHODS FOR TARGET MOLECULE CHARACTERIZATION UNIV ARIZONA STATE (US) 2009-05-28 WO disclosed
WO-1999063111-A2 METHOD OF LABELLING NUCLEIC ACID EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 1999-12-09 WO disclosed