SCHEMBL17359735

SCHEMBL17359735

C=C(C)C(=O)OC(CC(=O)O)C(=O)OC(=O)C(O)CC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
THRB P10828 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALOX15 P16050 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
SCHEMBL9394852 0.83 ALOX15 (0.41) TSHRSMN1; SMN2ALOX15
SCHEMBL721450 0.80 ALDH1A1 (0.43) TSHRSMN1; SMN2THRBALDH1A1ALOX15
Hydrochloric Acid SCHEMBL7208700 0.79 SMN1; SMN2 (0.44) TSHRSMN1; SMN2ALOX15
SCHEMBL1408304 0.79 THRB (0.41) TSHRSMN1; SMN2THRBALDH1A1ALOX15
SCHEMBL9556516 0.78 TDP1 (0.44) TSHRSMN1; SMN2ALOX15
SCHEMBL895686 0.78 TSHR (0.39) TSHRSMN1; SMN2THRBALDH1A1ALOX15
SCHEMBL3787421 0.78 TSHR (0.42) TSHRSMN1; SMN2THRBALDH1A1ALOX15
SCHEMBL9461207 0.77 TSHR (0.39) TSHRSMN1; SMN2THRBALDH1A1
Ammonia Solution, Strong SCHEMBL18140150 0.76 TSHR (0.38) TSHRSMN1; SMN2THRBALDH1A1ALOX15
SCHEMBL11801952 0.76 SMN1; SMN2 (0.35) TSHRSMN1; SMN2THRBALDH1A1

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-9221934-B2 Process and plant for manufacturing polyethylene-silane-copolymers BOREALIS AG (AT) 2015-12-29 US claimed