SCHEMBL6913142

SCHEMBL6913142

O=S(=O)(O)c1cccc(Cl)c1.[InH3]

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.57
TSHR P16473 2/20 0.57
HSD17B10 Q99714 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.52
PGR P06401 5/20 0.52
MMP2 P08253 1/20 0.50
FBP1 P09467 7/20 0.49
AKR1B1 P15121 1/20 0.49
FLT1 P17948 1/20 0.47
FLT4 P35916 1/20 0.47
KDR P35968 1/20 0.47

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
SCHEMBL29960292 0.98 ALDH1A1 (0.59) ALDH1A1TSHRHSD17B10TDP1MEN1
SCHEMBL294451 0.98 ALDH1A1 (0.59) ALDH1A1TSHRHSD17B10TDP1MEN1
SCHEMBL8477676 0.98 ALDH1A1 (0.59) ALDH1A1TSHRHSD17B10TDP1MEN1
SCHEMBL6916653 0.95 ALDH1A1 (0.57) ALDH1A1TSHRHSD17B10TDP1MEN1
SCHEMBL8720206 0.95 ALDH1A1 (0.57) ALDH1A1TSHRHSD17B10TDP1MEN1
SCHEMBL8718059 0.95 ALDH1A1 (0.57) ALDH1A1TSHRHSD17B10TDP1MEN1
Hydrochloric Acid SCHEMBL4589844 0.95 ALDH1A1 (0.57) ALDH1A1TSHRHSD17B10TDP1MEN1
SCHEMBL8719870 0.95 ALDH1A1 (0.57) ALDH1A1TSHRHSD17B10TDP1MEN1
SCHEMBL6914411 0.95 ALDH1A1 (0.57) ALDH1A1TSHRHSD17B10TDP1MEN1
SCHEMBL6918604 0.95 ALDH1A1 (0.57) ALDH1A1TSHRHSD17B10TDP1MEN1

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