SCHEMBL9514833

SCHEMBL9514833

C=C(C)C[C@H](C(=O)OC(C)C)[C@@H](O)C(=O)OC(C)C

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37

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
SCHEMBL7372261 1.00 TSHR (0.37) TSHR
SCHEMBL15847388 1.00 TSHR (0.37) TSHR
SCHEMBL15370173 0.84 TSHR (0.35) TSHR
SCHEMBL3288415 0.81 LMNA (0.37) TSHR
SCHEMBL15847142 0.75 TSHR (0.36) TSHR
SCHEMBL9514368 0.75 TSHR (0.36) TSHR
SCHEMBL7373706 0.75 TSHR (0.36) TSHR
SCHEMBL1609961 0.74 TSHR (0.33) TSHR
SCHEMBL8271856 0.74 TSHR (0.33) TSHR
SCHEMBL7114195 0.74 TSHR (0.33) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0379288-B1 Process and intermediates for isopropyl 3S-amino-2R-hydroxyalkanoates PFIZER (US) 1993-12-22 EP claimed
EP-0379288-A1 Process and intermediates for isopropyl 3S-amino-2R-hydroxyalkanoates PFIZER INC. (US) 1990-07-25 EP claimed
US-5166400-A Intermediates for isopropyl 3S-amino-2R-hydroxy-alkanoates PFIZER INC. (US) 1992-11-24 US disclosed
US-5036155-A Process for isopropyl 3S-amino-2R-hydroxy-alkanoates PFIZER INC. (US) 1991-07-30 US disclosed
US-4965372-A Process and intermediates for isopropyl 3S-amino-2R-hydroxy-alkanoates PFIZER INC. (US) 1990-10-23 US disclosed
EP-0379288-A1 Process and intermediates for isopropyl 3S-amino-2R-hydroxyalkanoates PFIZER INC. (US) 1990-07-25 EP disclosed