SCHEMBL5879752

SCHEMBL5879752

O=C(Cc1cccc(Cl)c1)N/N=C/c1cccnc1OS(=O)(=O)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.43
LMNA P02545 2/20 0.43
FFAR2 O15552 3/20 0.42
NPSR1 Q6W5P4 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
CCR6 P51684 1/20 0.40
ANO1 Q5XXA6 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
BRD4 O60885 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL5879755 1.00 CSNK1D (0.43) CSNK1DLMNAFFAR2NPSR1CYP1A2
SCHEMBL5879913 0.87 FFAR2 (0.41) CSNK1DLMNAFFAR2NPSR1CYP1A2
SCHEMBL5879917 0.87 FFAR2 (0.41) CSNK1DLMNAFFAR2NPSR1CYP1A2
SCHEMBL5880161 0.87 CYP1A2 (0.49) CSNK1DLMNAFFAR2NPSR1CYP1A2
SCHEMBL5880163 0.87 CYP1A2 (0.49) CSNK1DLMNAFFAR2NPSR1CYP1A2
SCHEMBL5879821 0.85 CSNK1D (0.42) CSNK1DLMNAFFAR2NPSR1CYP1A2
SCHEMBL5879826 0.85 CSNK1D (0.42) CSNK1DLMNAFFAR2NPSR1CYP1A2
SCHEMBL5880182 0.85 MEN1 (0.47) CSNK1DLMNAFFAR2NPSR1CYP1A2
SCHEMBL5880186 0.85 MEN1 (0.47) CSNK1DLMNAFFAR2NPSR1CYP1A2
SCHEMBL5879892 0.84 LMNA (0.43) CSNK1DLMNAFFAR2NPSR1CYP1A2

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