SCHEMBL6911929

SCHEMBL6911929

CC(c1ccccc1)[S+]([O-])c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MIF P14174 2/20 0.38
TAAR1 Q96RJ0 4/20 0.37
LMNA P02545 2/20 0.37
KDM4E B2RXH2 2/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2C P18825 1/20 0.35
CYP2D6 P10635 1/20 0.35
HIF1A Q16665 1/20 0.35
NOS2 P35228 1/20 0.35
ALDH1A1 P00352 2/20 0.34
DPP4 P27487 2/20 0.33

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
SCHEMBL777881 0.78 TDP1 (0.33) TAAR1LMNAKDM4EADRA2AADRA2C
SCHEMBL34254 0.78 TDP1 (0.33) TAAR1LMNAKDM4EADRA2AADRA2C
SCHEMBL16363530 0.78 TDP1 (0.33) TAAR1LMNAKDM4EADRA2AADRA2C
SCHEMBL776588 0.78 CYP2D6 (0.44) MIFTAAR1LMNAKDM4EADRA2A
SCHEMBL12954696 0.76 DPP4 (0.42) MIFTAAR1LMNAKDM4EADRA2A
SCHEMBL8107422 0.74 TSHR (0.35)
SCHEMBL778395 0.74 TDP1 (0.31)
SCHEMBL11760283 0.74 TAAR1 (0.31) TAAR1
SCHEMBL20124828 0.74 TAAR1 (0.43) MIFTAAR1LMNAKDM4EADRA2A
SCHEMBL3977898 0.73 TSHR (0.44) TAAR1LMNACYP2D6DPP4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727294-B2 RADIATION TRANSPARENT MOLDING MATERIALS MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2004-04-27 US disclosed
US-20010034419-A1 Radiation transparent molding materials MITSUBISHI ENGINEERING-PLASTICS CORPORATION (JP) 2001-10-25 US disclosed