SCHEMBL8905012

SCHEMBL8905012

COCCOCO[C@H](C)C1C(=O)NC1CC(=O)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31

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
SCHEMBL8905034 1.00 TSHR (0.31) TSHR
SCHEMBL9395306 1.00 TSHR (0.31) TSHR
SCHEMBL9395343 1.00 TSHR (0.31) TSHR
SCHEMBL9395370 0.88 MAPT (0.33) TSHR
SCHEMBL9395290 0.88 MAPT (0.33) TSHR
SCHEMBL11196706 0.82
SCHEMBL10744450 0.81
Cyclohexylamine SCHEMBL8904557 0.78
SCHEMBL11007223 0.76
SCHEMBL9497024 0.76 ALOX5 (0.34) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5633243-A Anti-tumor platinum complexes, their preparation and their therapeutic use SANKYO COMPANY, LIMITED (JP) 1997-05-27 US disclosed