SCHEMBL28309484

SCHEMBL28309484

CCC=C(C)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(F)(F)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.38

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
SCHEMBL28291218 0.98 THRB (0.34) THRB
SCHEMBL28272996 0.83 THRB (0.35) THRB
SCHEMBL28174290 0.81 THRB (0.32) THRB
SCHEMBL1017602 0.75
SCHEMBL11553004 0.72 THRB (0.47) THRB
SCHEMBL4145565 0.72 THRB (0.47) THRB
SCHEMBL11547360 0.72 THRB (0.47) THRB
SCHEMBL11552746 0.72 THRB (0.47) THRB
SCHEMBL11548213 0.72 THRB (0.47) THRB
SCHEMBL338910 0.72 THRB (0.47) THRB

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
CN-110158060-A A kind of multilayered structure and preparation method thereof 清华大学深圳研究生院 2019-08-23 CN claimed