SCHEMBL8855697

SCHEMBL8855697

C=CC[C@](C)(C(=O)O)N(CC=O)CC=O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL7603110 0.76 TSHR (0.37) ALDH1A1TSHR
SCHEMBL8855575 0.74 ALDH1A1 (0.33) ALDH1A1TSHR
Acetic Acid SCHEMBL27987775 0.73 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL8855545 0.68 ALDH1A1 (0.35) ALDH1A1TSHR
SCHEMBL28215511 0.67 TSHR (0.33) TSHR
SCHEMBL8855747 0.67
SCHEMBL7398042 0.67 L3MBTL1 (0.33) ALDH1A1TSHR
SCHEMBL8855673 0.67
SCHEMBL528085 0.66 TSHR (0.42) ALDH1A1TSHR
SCHEMBL11812638 0.66 TSHR (0.46) ALDH1A1TSHR

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-5686603-A DERIVED FROM CARBOHYDRATES, SUGARS LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1997-11-11 US disclosed