SCHEMBL7996032

SCHEMBL7996032

C[C@@H]1C[C@H](N(C)C(=O)O)C[C@H](O)O1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL8004779 1.00 TSHR (0.30) TSHR
SCHEMBL8004313 0.85 TSHR (0.33) TSHR
SCHEMBL8006927 0.80
SCHEMBL8226973 0.78
SCHEMBL1764413 0.78
SCHEMBL13718133 0.78
SCHEMBL8010419 0.78
SCHEMBL8229214 0.78
SCHEMBL13717518 0.78
SCHEMBL13018009 0.78

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
WO-2009106419-A1 NEW MACROLIDES AND THEIR USE BASILEA PHARMACEUTICA AG (CH) 2009-09-03 WO disclosed