SCHEMBL7994907

SCHEMBL7994907

CC1CNCCN1S(=O)(=O)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.53
MMP1 P03956 5/20 0.48
MMP9 P14780 5/20 0.48
MMP13 P45452 5/20 0.48
MMP3 P08254 1/20 0.48
MMP7 P09237 1/20 0.48
HTR2A P28223 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
PRKD3 O94806 2/20 0.42
PRKCG P05129 2/20 0.42
PRKCB P05771 2/20 0.42
PRKCA P17252 2/20 0.42
PRKACA P17612 2/20 0.42
PRKACG P22612 2/20 0.42
PRKACB P22694 2/20 0.42
PRKCH P24723 2/20 0.42
PRKCI P41743 2/20 0.42
PRKCE Q02156 2/20 0.42
PRKCQ Q04759 2/20 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
SCHEMBL7980137 1.00 HSD11B1 (0.53) HSD11B1MMP1MMP9MMP13MMP3
Hydrochloric Acid SCHEMBL309662 0.99 HSD11B1 (0.52) HSD11B1MMP1MMP9MMP13MMP3
Hydrochloric Acid SCHEMBL309881 0.99 HSD11B1 (0.52) HSD11B1MMP1MMP9MMP13MMP3
SCHEMBL10042202 0.84 MMP1 (0.65) HSD11B1MMP1MMP9MMP13MMP3
SCHEMBL6410896 0.83 HSD11B1 (0.48) HSD11B1MMP1MMP9MMP13MMP3
SCHEMBL7991187 0.83 HSD11B1 (0.48) HSD11B1MMP1MMP9MMP13MMP3
Hydrochloric Acid SCHEMBL308298 0.82 HSD11B1 (0.47) HSD11B1MMP1MMP9MMP13MMP3
Hydrochloric Acid SCHEMBL309182 0.82 HSD11B1 (0.47) HSD11B1MMP1MMP9MMP13MMP3
SCHEMBL3718844 0.79 PSEN1 (0.61) HSD11B1MMP1MMP9MMP13MMP3
SCHEMBL7892632 0.79 PSEN1 (0.61) HSD11B1MMP1MMP9MMP13MMP3

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-2010007074-A1 PYRAZOLO [1, 5-A] PYRIMIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2010-01-21 WO disclosed