SCHEMBL17857648

SCHEMBL17857648

CCOC(N)COCC(O)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL8645129 0.77 TSHR (0.50) TSHR
SCHEMBL1034994 0.74
SCHEMBL9700118 0.69 ALDH1A1 (0.48) TSHR
SCHEMBL15053611 0.69
Acetic Acid SCHEMBL5962170 0.68 ALDH1A1 (0.34) TSHR
SCHEMBL16266944 0.67 GLA (0.35) TSHR
SCHEMBL7360964 0.65
SCHEMBL3978796 0.65
SCHEMBL28310377 0.64 TSHR (0.41) TSHR
SCHEMBL7881636 0.64 ADRB2 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9376756-B2 Inhibition of corrosion in boiler systems with etheramines EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2016-06-28 US claimed