SCHEMBL10341835

SCHEMBL10341835

C#CC(O)c1c(F)c(F)c(C(F)(F)F)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 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
SCHEMBL1815617 0.82
SCHEMBL10341881 0.79 TSHR (0.32) TSHRSMN1; SMN2
SCHEMBL10341798 0.71 SMN1; SMN2 (0.34) TSHRSMN1; SMN2
SCHEMBL8979606 0.70
SCHEMBL25920920 0.68 SMN1; SMN2 (0.33) TSHRSMN1; SMN2
SCHEMBL7200065 0.68 PDE2A (0.40)
SCHEMBL312355 0.68 SMN1; SMN2 (0.42) TSHRSMN1; SMN2
SCHEMBL2480870 0.67 TSHR (0.33) TSHRSMN1; SMN2
SCHEMBL15425914 0.66 SMN1; SMN2 (0.32) TSHRSMN1; SMN2
SCHEMBL25920925 0.65 SMN1; SMN2 (0.31) TSHRSMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0181284-B1 AMINO ACID ESTERS SANDOZ AG (CH) 1990-02-07 EP disclosed
EP-0181284-A1 Amino acid esters SANDOZ AG (CH) 1986-05-14 EP disclosed