SCHEMBL7571934

SCHEMBL7571934

CCCC1c2nc[nH]c2CCN1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.46
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
POLB P06746 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
Trifluoroacetic Acid SCHEMBL7572001 0.83 AOC3 (0.43) AOC3RAB9AKDM4EALDH1A1GAA
Trifluoroacetic Acid SCHEMBL7525401 0.82 AOC3 (0.43) AOC3PDE4D
SCHEMBL7528897 0.81 AOC3 (0.54) AOC3KDM4EALDH1A1POLB
SCHEMBL7527428 0.81 AOC3 (0.47) AOC3
SCHEMBL7528894 0.81 AOC3 (0.46) AOC3ALDH1A1POLB
SCHEMBL7528248 0.81 AOC3 (0.46) AOC3
SCHEMBL7568713 0.80 AOC3 (0.49) AOC3RAB9AKDM4EGAASMN1; SMN2
SCHEMBL10325666 0.79 AOC3 (0.47) AOC3RAB9AKDM4EALDH1A1GAA
Trifluoroacetic Acid SCHEMBL7532741 0.78 AOC3 (0.48) AOC3ALDH1A1GAA
Trifluoroacetic Acid SCHEMBL7530958 0.78 AOC3 (0.40) AOC3ALDH1A1

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
WO-2002038153-A1 NEW USE OF 4, 5, 6, 7-TETRAHYDROIMIDAZO-[4,5-C]PYRIDINE DERIVATIVES BIOVITRUM AB (SE) 2002-05-16 WO disclosed