SCHEMBL5381073

SCHEMBL5381073

CC(=CC1(C(=O)OC(C)C)CC1(C)C)CO

nearest known ligand 0.32

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
SCHEMBL5381067 1.00 TSHR (0.32) TSHR
SCHEMBL5368585 0.81 MEN1 (0.30)
SCHEMBL5368589 0.81 MEN1 (0.30)
SCHEMBL27626840 0.80 CYP2D6 (0.31)
SCHEMBL5381062 0.79 POLB (0.35)
SCHEMBL5381059 0.79 POLB (0.35)
SCHEMBL5369185 0.79 TSHR (0.33) TSHR
SCHEMBL5373360 0.79 TSHR (0.33) TSHR
SCHEMBL5373356 0.79 TSHR (0.33) TSHR
SCHEMBL5369181 0.79 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276622-B2 Method for producing oxygen-containing compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-02 US disclosed