SCHEMBL9544225

SCHEMBL9544225

C=CC(C)C(C)OC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.32
TSHR P16473 2/20 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
SCHEMBL9544214 0.81 TSHR (0.31) TSHR
SCHEMBL981827 0.79 HCAR2 (0.31) HCAR2TSHR
SCHEMBL1936262 0.76 TSHR (0.40) HCAR2TSHR
SCHEMBL1352111 0.75
SCHEMBL9277707 0.71 HCAR2 (0.32) HCAR2TSHR
SCHEMBL19359798 0.71
SCHEMBL9704864 0.71 TSHR (0.36) HCAR2TSHR
SCHEMBL222174 0.71
Propene SCHEMBL4353692 0.70 HCAR2 (0.44) HCAR2TSHR
SCHEMBL16353963 0.70 HCAR2 (0.31) HCAR2TSHR

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-1993011669-A1 USE OF 3-PHENYLURACIL DERIVATIVES FOR THE DESICCATION AND ABSCISSION OF PLANT PARTS BASF AKTIENGESELLSCHAFT (DE) 1993-06-24 WO disclosed