SCHEMBL11113864

SCHEMBL11113864

[CH2]c1ccccc1OC(F)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ULK1 O75385 1/20 0.33

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
SCHEMBL2164883 0.85 ULK1 (0.33) ULK1
SCHEMBL885349 0.79 DRD1 (0.42) ULK1
SCHEMBL7799614 0.76 ALDH1A1 (0.43) ULK1
SCHEMBL4790422 0.76 CA2 (0.43)
SCHEMBL8984707 0.76 HTR1A (0.37) ULK1
SCHEMBL1843243 0.76 NPSR1 (0.35)
SCHEMBL943898 0.74 MEN1 (0.31)
SCHEMBL11113862 0.73 TSHR (0.35)
SCHEMBL6742290 0.73 MEN1 (0.30)
SCHEMBL7219313 0.73 DRD1 (0.46)

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-4438275-A 2,2-DIFLUORO-BENZODIOXOLES BAYER AKTIENGESELLSCHAFT (DE) 1984-03-20 US disclosed