SCHEMBL5879948

SCHEMBL5879948

O=C(Cc1cccc(F)c1)NN=Cc1ccccc1OS(=O)(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.46
KMT2A Q03164 5/20 0.46
MAPT P10636 5/20 0.46
MEN1 O00255 3/20 0.46
HTT P42858 3/20 0.46
SGK1 O00141 1/20 0.43
ALDH1A1 P00352 4/20 0.43
CYP1A2 P05177 2/20 0.43
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CYP2D6 P10635 1/20 0.42
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
PTBP1 P26599 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 1/20 0.40

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
SCHEMBL5879946 1.00 LMNA (0.46) LMNAKMT2AMAPTMEN1HTT
SCHEMBL5880055 0.93 LMNA (0.47) LMNAKMT2AMAPTMEN1HTT
SCHEMBL5880051 0.93 LMNA (0.47) LMNAKMT2AMAPTMEN1HTT
SCHEMBL5880161 0.91 CYP1A2 (0.49) LMNAKMT2AMAPTMEN1HTT
SCHEMBL5880163 0.91 CYP1A2 (0.49) LMNAKMT2AMAPTMEN1HTT
SCHEMBL5880030 0.91 LMNA (0.46) LMNAKMT2AMAPTMEN1HTT
SCHEMBL5880036 0.91 LMNA (0.46) LMNAKMT2AMAPTMEN1HTT
SCHEMBL5880038 0.91 LMNA (0.48) LMNAKMT2AMAPTMEN1HTT
SCHEMBL5880033 0.91 LMNA (0.48) LMNAKMT2AMAPTMEN1HTT
SCHEMBL5880090 0.91 MEN1 (0.54) LMNAKMT2AMAPTMEN1HTT

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
US-7026339-B2 Inhibitors of HCV NS5B polymerase PFIZER INC. 2006-04-11 US disclosed