SCHEMBL19086270

SCHEMBL19086270

CC[CH]C(O)C(CO)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.35
TSHR P16473 1/20 0.30

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
SCHEMBL6437408 0.72
SCHEMBL6435367 0.71
SCHEMBL1614889 0.69 TSHR (0.50) TDP1TSHR
SCHEMBL903728 0.69
SCHEMBL17068991 0.68
SCHEMBL13091478 0.68
SCHEMBL14297607 0.68
SCHEMBL12329986 0.68
SCHEMBL12868902 0.68
SCHEMBL8370907 0.68

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-2664619-B1 Purine derivatives as tools for screening anti-Alzheimer compounds MANROS THERAPEUTICS (FR) 2017-07-12 EP disclosed