SCHEMBL1667678

SCHEMBL1667678

C=C(C)c1c(C(=N)NO)c2cccnc2n1-c1ccc(O)cc1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 1/20 0.33
USP14 P54578 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPK8 P45983 2/20 0.31
PPARG P37231 1/20 0.31
APP P05067 1/20 0.30
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 1/20 0.30
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 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
SCHEMBL1667733 0.88 FEN1 (0.32) FEN1USP14ALDH1A1MAPK8PPARG
SCHEMBL1667676 0.80 NTRK1 (0.34) FEN1USP14ALDH1A1PPARGPDE4A
SCHEMBL1667778 0.80 USP14 (0.36) FEN1USP14ALDH1A1APPPDE4A
SCHEMBL1667677 0.80 NTRK1 (0.34) FEN1USP14ALDH1A1PPARGPDE4A
SCHEMBL1667702 0.76 BRD4 (0.36) USP14ALDH1A1TSHRCYP2C19
SCHEMBL1667884 0.75 USP14 (0.33) FEN1USP14ALDH1A1PDE4APDE4B
SCHEMBL1667769 0.75 ELANE (0.39) FEN1USP14PPARGPDE4APDE4B
SCHEMBL1668168 0.75 USP14 (0.33) FEN1USP14ALDH1A1MAPK8PDE4B
SCHEMBL1667747 0.74 USP14 (0.33) USP14ALDH1A1
SCHEMBL1670139 0.72 USP14 (0.32) USP14

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-2011042474-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 WO claimed