SCHEMBL1667733

SCHEMBL1667733

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

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 1/20 0.32
APP P05067 1/20 0.32
USP14 P54578 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PPARG P37231 1/20 0.30
MAPK8 P45983 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KLK7 P49862 1/20 0.30
KMT2A Q03164 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
SCHEMBL1667678 0.88 FEN1 (0.33) FEN1APPUSP14ALDH1A1PPARG
SCHEMBL1668112 0.82 HSP90AA1 (0.41) FEN1USP14KDM4EPPARGMAPK8
SCHEMBL1668113 0.82 HSP90AA1 (0.41) FEN1USP14KDM4EPPARGMAPK8
SCHEMBL1668111 0.82 HSP90AA1 (0.41) FEN1USP14KDM4EPPARGMAPK8
SCHEMBL22227504 0.81 HPGD (0.33) ALDH1A1KDM4EMAPTSMN1; SMN2PPARG
SCHEMBL1077736 0.81 HPGD (0.33) ALDH1A1KDM4EMAPTSMN1; SMN2PPARG
SCHEMBL1667729 0.80 NTRK1 (0.33) FEN1APPUSP14PPARG
SCHEMBL1667736 0.80 NTRK1 (0.33) FEN1APPUSP14PPARG
SCHEMBL1667731 0.80 NTRK1 (0.33) FEN1APPUSP14PPARG
SCHEMBL12797903 0.79 FEN1 (0.34) FEN1APPALDH1A1PPARGMAPK8

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