SCHEMBL8068178

SCHEMBL8068178

NC(=O)N(O)CC1=Cc2sc(Cc3ncc[nH]3)cc2CC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.32
TBXAS1 P24557 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
SCHEMBL6439731 0.78 TBXAS1 (0.53) TBXAS1
SCHEMBL10773726 0.77 TBXAS1 (0.42) TBXAS1
SCHEMBL10775474 0.74 TBXAS1 (0.40) TBXAS1
Hydrochloric Acid SCHEMBL10775884 0.62 TBXAS1 (0.53) TBXAS1
SCHEMBL10774871 0.62 TBXAS1 (0.53) TBXAS1
SCHEMBL10772872 0.61 TBXAS1 (0.42) TBXAS1
SCHEMBL1807964 0.60 TAAR1 (0.46) TBXAS1
SCHEMBL10777505 0.60 TBXAS1 (0.40) TBXAS1
SCHEMBL1793714 0.58 TAAR1 (0.51) TBXAS1
SCHEMBL10915640 0.58 ADRA1D (0.54)

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
JP-2000256355-A N-HYDROXYUREA DERIVATIVE NIKKEN CHEM CO LTD 2000-09-19 JP disclosed