SCHEMBL5879965

SCHEMBL5879965

CCc1ccc(S(=O)(=O)N/N=C/c2ccccc2OS(=O)(=O)c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.50
LMNA P02545 8/20 0.50
CYP3A4 P08684 3/20 0.50
CYP2C9 P11712 3/20 0.50
CYP2C19 P33261 3/20 0.50
CYP1A2 P05177 2/20 0.50
MEN1 O00255 8/20 0.48
KMT2A Q03164 8/20 0.48
NPSR1 Q6W5P4 4/20 0.48
GAA P10253 3/20 0.48
RECQL P46063 1/20 0.48
HTT P42858 2/20 0.45
ALDH1A1 P00352 6/20 0.45
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 2/20 0.43
PKM P14618 1/20 0.43
POLB P06746 1/20 0.42
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL5879968 1.00 MAPT (0.50) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL5879609 0.90 GAA (0.53) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL5879610 0.90 GAA (0.53) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL5879987 0.89 MAPT (0.58) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL5879992 0.89 MAPT (0.58) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL5880042 0.85 LMNA (0.45) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL5880048 0.85 LMNA (0.45) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL5880034 0.82 MAPT (0.44) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL5880039 0.82 MAPT (0.44) MAPTLMNACYP3A4CYP2C9CYP2C19
SCHEMBL5880011 0.79 MAPT (0.42) MAPTLMNACYP3A4CYP2C9CYP2C19

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