SCHEMBL6089801

SCHEMBL6089801

CCOC(=O)N1CCc2c(oc3cc(C=C4C(=O)N5C(C(=O)O)=CSC45)nn23)C1

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32

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
SCHEMBL3588111 1.00 TSHR (0.32) TSHR
SCHEMBL3588108 1.00 TSHR (0.32) TSHR
SCHEMBL3226544 0.86 TSHR (0.32) TSHR
SCHEMBL4254553 0.81
SCHEMBL6416325 0.81
SCHEMBL4254548 0.81
SCHEMBL3551263 0.81 TSHR (0.33) TSHR
SCHEMBL3551261 0.81 TSHR (0.33) TSHR
SCHEMBL3584679 0.79 TP53 (0.36)
SCHEMBL6415305 0.79

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-7018997-B2 Tricyclic 6-alkylidene-penems as β-lactamase inhibitors WYETH (US) 2006-03-28 US claimed