SCHEMBL5880283

SCHEMBL5880283

COc1cc(CC(=O)N/N=C/c2ccccc2OS(=O)(=O)c2ccc(C(F)(F)F)cc2)cc(OC)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.47
MAPT P10636 6/20 0.47
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
HTT P42858 3/20 0.47
ALDH1A1 P00352 5/20 0.45
GAA P10253 3/20 0.43
KDM4E B2RXH2 1/20 0.43
EYA2 O00167 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SGK1 O00141 1/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
UBE2N P61088 1/20 0.42
POLB P06746 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL5880289 1.00 LMNA (0.47) LMNAMAPTKMT2AMEN1HTT
SCHEMBL5880113 0.93 SGK1 (0.48) LMNAMAPTKMT2AMEN1HTT
SCHEMBL5880115 0.93 SGK1 (0.48) LMNAMAPTKMT2AMEN1HTT
SCHEMBL5879902 0.92 KMT2A (0.52) LMNAMAPTKMT2AMEN1HTT
SCHEMBL5879904 0.92 KMT2A (0.52) LMNAMAPTKMT2AMEN1HTT
SCHEMBL5879679 0.90 LMNA (0.47) LMNAMAPTKMT2AMEN1HTT
SCHEMBL5879681 0.90 LMNA (0.47) LMNAMAPTKMT2AMEN1HTT
SCHEMBL5880282 0.90 LMNA (0.49) LMNAMAPTKMT2AMEN1HTT
SCHEMBL5880285 0.90 LMNA (0.49) LMNAMAPTKMT2AMEN1HTT
SCHEMBL5880288 0.90 LMNA (0.48) LMNAMAPTKMT2AMEN1HTT

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