SCHEMBL7101725

SCHEMBL7101725

Cc1ccc(S(=O)(=O)Sc2cc(C)c(OS(=O)(=O)N3CCNCC3C)cc2C(C)(C)C)cc1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 4/20 0.32
PRKD3 O94806 3/20 0.32
PRKACG P22612 3/20 0.32
PRKACB P22694 3/20 0.32
PRKCZ Q05513 3/20 0.32
PRKCD Q05655 3/20 0.32
PRKCG P05129 2/20 0.32
PRKCB P05771 2/20 0.32
PRKCA P17252 2/20 0.32
PRKCH P24723 2/20 0.32
PRKCI P41743 2/20 0.32
PRKCE Q02156 2/20 0.32
PRKCQ Q04759 2/20 0.32
PRKD1 Q15139 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL5880792 0.78 KMT2A (0.38) SMN1; SMN2TSHRMAPK1KMT2AALDH1A1
SCHEMBL5880745 0.76 DNMT1 (0.41) MEN1CYP3A4CYP2D6CYP2C9MAPK1
SCHEMBL7998562 0.73 DNMT1 (0.38) LMNADNMT1
SCHEMBL8007831 0.72 DNMT1 (0.38) MEN1KMT2AALDH1A1LMNADNMT1
SCHEMBL5880867 0.72 LMNA (0.39) MEN1MAPK1KMT2AALDH1A1LMNA
SCHEMBL5880727 0.71 BCHE (0.42) SMN1; SMN2MEN1MAPK1KMT2AALDH1A1
SCHEMBL5880739 0.71 ALDH1A1 (0.38) MEN1TSHRKMT2AHTTALDH1A1
SCHEMBL8008848 0.70 PTGDR2 (0.43) CYP2C19DNMT1
SCHEMBL7999810 0.69 DNMT1 (0.38) DNMT1
SCHEMBL5880828 0.69 DNMT1 (0.32) SMN1; SMN2MAPK1ALDH1A1DNMT1

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-2003095441-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME PFIZER INC. (US) 2003-11-20 WO disclosed