SCHEMBL6908682

SCHEMBL6908682

O=S(=O)([O-])c1ccccc1Cl.O=S(=O)([O-])c1ccccc1Cl.O=S(=O)([O-])c1ccccc1Cl.[In+3]

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.50
TSHR P16473 2/20 0.44
GAA P10253 1/20 0.44
HSD17B10 Q99714 1/20 0.44
ALDH1A1 P00352 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NFE2L2 Q16236 7/20 0.43
LMNA P02545 1/20 0.43
AKR1B1 P15121 1/20 0.42
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
PGR P06401 1/20 0.41
PKM P14618 1/20 0.40

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
Lithium Ion SCHEMBL3709427 0.98 HSD11B1 (0.48) HSD11B1TSHRGAAHSD17B10ALDH1A1
Potassium Ion SCHEMBL3708312 0.98 HSD11B1 (0.48) HSD11B1TSHRGAAHSD17B10ALDH1A1
SCHEMBL6247405 0.98 HSD11B1 (0.50) HSD11B1TSHRGAAHSD17B10ALDH1A1
SCHEMBL6909483 0.98 HSD11B1 (0.48) HSD11B1TSHRGAAHSD17B10ALDH1A1
SCHEMBL6913303 0.98 HSD11B1 (0.48) HSD11B1TSHRGAAHSD17B10ALDH1A1
SCHEMBL1421724 0.98 HSD11B1 (0.48) HSD11B1TSHRGAAHSD17B10ALDH1A1
Zinc Ion SCHEMBL6917689 0.98 HSD11B1 (0.48) HSD11B1TSHRGAAHSD17B10ALDH1A1
SCHEMBL6912706 0.98 HSD11B1 (0.48) HSD11B1TSHRGAAHSD17B10ALDH1A1
SCHEMBL6913965 0.98 HSD11B1 (0.48) HSD11B1TSHRGAAHSD17B10ALDH1A1
SCHEMBL6918636 0.98 HSD11B1 (0.48) HSD11B1TSHRGAAHSD17B10ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6830704-B2 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. (JP) 2004-12-14 US disclosed
US-20030135016-A1 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. 2003-07-17 US disclosed
US-6547985-B1 Adhesive mixture TOGOSEI CO., LTD. (JP) 2003-04-15 US disclosed