SCHEMBL5044768

SCHEMBL5044768

C[N+](OCCO)(OCCO)OCCO.F[B-](F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL638342 0.89 TSHR (0.39) ALDH1A1TSHRMAPK1MEN1KMT2A
Fluoride Ion SCHEMBL190628 0.86 TSHR (0.37) ALDH1A1TSHRMAPK1MEN1KMT2A
Bromide SCHEMBL28550756 0.86 MEN1 (0.38) ALDH1A1TSHRMAPK1MEN1KMT2A
Fluoride SCHEMBL27656504 0.86 TSHR (0.37) ALDH1A1TSHRMAPK1MEN1KMT2A
Water SCHEMBL1358543 0.86 TSHR (0.37) ALDH1A1TSHRMAPK1MEN1KMT2A
Hydrochloric Acid SCHEMBL2444153 0.86 CYP3A4 (0.38) ALDH1A1TSHRMAPK1MEN1KMT2A
SCHEMBL27656499 0.84 ALDH1A1 (0.32) ALDH1A1TSHRMAPK1MEN1KMT2A
Water SCHEMBL11035195 0.83 TSHR (0.35) ALDH1A1TSHRMAPK1MEN1KMT2A
SCHEMBL3750721 0.77 ALDH1A1 (0.31) ALDH1A1TSHRMAPK1
Sulfuric Acid SCHEMBL27564936 0.77 ALDH1A1 (0.31) ALDH1A1TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1680806-A4 CLEANING SOLUTIONS AND ETCHANTS AND METHODS FOR USING SAME SACHEM INC (US) 2008-07-30 EP disclosed
US-7192910-B2 Cleaning solutions and etchants and methods for using same SACHEM, INC. (US) 2007-03-20 US disclosed
EP-1680806-A2 CLEANING SOLUTIONS AND ETCHANTS AND METHODS FOR USING SAME Sachem, Inc. (US) 2006-07-19 EP disclosed
US-20050143270-A1 Cleaning solutions and etchants and methods for using same SACHEM, INC. 2005-06-30 US disclosed
WO-2005045895-A2 CLEANING SOLUTIONS AND ETCHANTS AND METHODS FOR USING SAME SACHEM, INC. (US) 2005-05-19 WO disclosed