SCHEMBL6915523

SCHEMBL6915523

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.55
ALDH1A1 P00352 1/20 0.55
HSD17B10 Q99714 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.50
ATM Q13315 1/20 0.47
MBTD1 Q05BQ5 1/20 0.44
L3MBTL3 Q96JM7 1/20 0.44
BRD4 O60885 1/20 0.44
WDR5 P61964 1/20 0.44
HSD17B2 P37059 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
MMP2 P08253 1/20 0.42
KAT6A Q92794 2/20 0.42
FLT1 P17948 1/20 0.42
FLT4 P35916 1/20 0.42
KDR P35968 1/20 0.42
PGR P06401 1/20 0.41
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41

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
SCHEMBL711206 0.98 TSHR (0.57) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL6915527 0.96 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL6918780 0.96 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
Hydrochloric Acid SCHEMBL27892853 0.96 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL6917498 0.96 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL28559296 0.96 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL6913054 0.96 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL6914906 0.96 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL6914622 0.96 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL6916893 0.96 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2

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