SCHEMBL6916922

SCHEMBL6916922

O=S(=O)(O)c1ccccc1Br.[AlH3]

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
CA4 P22748 2/20 0.60
CA6 P23280 2/20 0.60
PLCG1 P19174 1/20 0.56
RECQL P46063 1/20 0.43
MAPT P10636 1/20 0.43
MYC P01106 1/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TTR P02766 2/20 0.41
AKR1B1 P15121 1/20 0.41
POLB P06746 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LOX P28300 1/20 0.40
CA12 O43570 1/20 0.38
CYP2C9 P11712 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 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
SCHEMBL122413 0.98 CA1 (0.62) CA1CA2CA4CA6PLCG1
SCHEMBL30873490 0.98 CA1 (0.62) CA1CA2CA4CA6PLCG1
SCHEMBL6914824 0.95 CA1 (0.60) CA1CA2CA4CA6PLCG1
SCHEMBL6914855 0.95 CA1 (0.60) CA1CA2CA4CA6PLCG1
SCHEMBL28389071 0.95 CA1 (0.60) CA1CA2CA4CA6PLCG1
SCHEMBL6915503 0.95 CA1 (0.60) CA1CA2CA4CA6PLCG1
SCHEMBL6914826 0.95 CA1 (0.60) CA1CA2CA4CA6PLCG1
SCHEMBL6913327 0.95 CA1 (0.60) CA1CA2CA4CA6PLCG1
SCHEMBL6915545 0.95 CA1 (0.60) CA1CA2CA4CA6PLCG1
Hydrochloric Acid SCHEMBL2641945 0.95 CA1 (0.60) CA1CA2CA4CA6PLCG1

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