SCHEMBL3657889

SCHEMBL3657889

C=C([K])C(=O)NC(C)S(=O)(=O)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31

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
SCHEMBL347486 0.81 TGFBR1 (0.47) TSHR
SCHEMBL9770382 0.79 TGFBR1 (0.46) TSHR
SCHEMBL7038954 0.75 ALDH1A1 (0.37) TSHR
SCHEMBL3660408 0.75 TGFBR1 (0.31)
SCHEMBL27449660 0.74 TGFBR1 (0.42)
Hydrochloric Acid SCHEMBL11522602 0.73 ALDH1A1 (0.35) TSHR
SCHEMBL454340 0.72 TSHR (0.58) TSHR
SCHEMBL14344054 0.72 HDAC7 (0.33) TSHR
Potassium SCHEMBL9499549 0.71 TSHR (0.56) TSHR
Ammonia Solution, Strong SCHEMBL31228319 0.71 TSHR (0.56) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2215134-A2 REDUCTION OF THE FORMATION OF BIOFILM BY MEANS OF MULTIFUNCTIONAL COPOLYMERS Henkel AG & Co. KGaA (DE) 2010-08-11 EP disclosed
WO-2009071451-A2 REDUCTION OF THE FORMATION OF BIOFILM BY MEANS OF MULTIFUNCTIONAL COPOLYMERS HENKEL AG & CO. KGAA (DE) 2009-06-11 WO disclosed