SCHEMBL10695738

SCHEMBL10695738

CC(C)(C(=O)Cl)C(Br)(Br)Br

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 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
SCHEMBL133530 0.81
SCHEMBL1651409 0.81
SCHEMBL2154133 0.81 TSHR (0.38) ALDH1A1TSHR
SCHEMBL1251110 0.72
SCHEMBL1404 0.72
SCHEMBL50101 0.72 TSHR (0.38) ALDH1A1TSHR
SCHEMBL138742 0.71 THRB (0.41) ALDH1A1TSHR
SCHEMBL15187619 0.71 TSHR (0.33) ALDH1A1TSHR
SCHEMBL3689675 0.69 TSHR (0.53) ALDH1A1TSHR
SCHEMBL94994 0.69

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
EP-0257753-A1 Novel derivatives of trihalopivalic acids, method for their preparation and their use Bromine Compounds Ltd. (IL) 1988-03-02 EP disclosed