SCHEMBL5465236

SCHEMBL5465236

CC(N)(O)Cc1ccccc1.O=S(=O)(O)OS(=O)(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.44
HIF1A Q16665 1/20 0.44
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPRA P18433 1/20 0.40
PTPRB P23467 1/20 0.40
FDPS P14324 1/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
MMP1 P03956 2/20 0.38
MMP9 P14780 2/20 0.38
MMP13 P45452 2/20 0.38
LMNA P02545 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 2/20 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
Sulfuric Acid SCHEMBL5465234 0.90 SLC6A2 (0.55) SLC6A2TAAR1SMN1; SMN2HIF1APTPN2
SCHEMBL1698269 0.84 SLC6A2 (0.67) SLC6A2TAAR1SMN1; SMN2HIF1AFDPS
Phosphoric Acid SCHEMBL5459504 0.79 FDPS (0.58) SLC6A2TAAR1SMN1; SMN2HIF1AFDPS
SCHEMBL1666735 0.78 SLC6A2 (0.50) SLC6A2TAAR1SMN1; SMN2HIF1APTPN2
SCHEMBL6093963 0.78 SLC6A2 (0.50) SLC6A2TAAR1SMN1; SMN2HIF1APTPN2
Isopropyl Alcohol SCHEMBL9580322 0.77 SLC6A2 (0.57) SLC6A2TAAR1SMN1; SMN2HIF1AFDPS
Phentermine SCHEMBL28338903 0.77 SLC6A2 (0.76) SLC6A2TAAR1SMN1; SMN2HIF1APTPN2
Pyrophosphoric Acid SCHEMBL5459506 0.77 FDPS (0.51) SLC6A2TAAR1SMN1; SMN2HIF1APTPN1
Phentermine SCHEMBL28815884 0.75 SLC6A2 (0.73) SLC6A2TAAR1SMN1; SMN2HIF1APTPN2
SCHEMBL10661517 0.74 SMN1; SMN2 (0.48) SLC6A2TAAR1SMN1; SMN2HIF1APTPN2

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-20070210476-A1 Machinable Resin Molded Product, Material For Forming The Same, And Model Made Of The Same SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2007-09-13 US disclosed
EP-1728832-A1 MOLDING OF RESIN FOR CUTTING OPERATION, MATERIAL FOR FORMATION THEREOF AND MODEL Sanyo Chemical Industries, Ltd. (JP) 2006-12-06 EP disclosed