SCHEMBL5482072

SCHEMBL5482072

C=C(C)C(=O)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(O)F

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
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
SCHEMBL5488034 1.00 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL17257833 1.00 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL15157568 0.88 GAA (0.38) ALDH1A1TSHR
SCHEMBL8467259 0.88 GAA (0.38) ALDH1A1TSHR
SCHEMBL8520641 0.87 TSHR (0.34) ALDH1A1TSHR
SCHEMBL16504610 0.87 TSHR (0.34) ALDH1A1TSHR
SCHEMBL437657 0.87 TSHR (0.34) ALDH1A1TSHR
SCHEMBL1667267 0.87 TSHR (0.34) ALDH1A1TSHR
SCHEMBL18260684 0.87 TSHR (0.34) ALDH1A1TSHR
SCHEMBL15921891 0.87 TSHR (0.34) ALDH1A1TSHR

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-1744186-A1 MICROLENS Omron Corporation (JP) 2007-01-17 EP disclosed