SCHEMBL28604147

SCHEMBL28604147

CP(C)(=O)OCC(=O)C1(F)CCCCC1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 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
SCHEMBL28604148 0.86
SCHEMBL27755242 0.73 FFAR3 (0.36)
SCHEMBL27755360 0.71 DGAT1 (0.36)
SCHEMBL10477604 0.71 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL10477606 0.71 SMN1; SMN2 (0.40) SMN1; SMN2
SCHEMBL19699898 0.70 SMN1; SMN2 (0.33) SMN1; SMN2
SCHEMBL17558776 0.69 TSHR (0.36)
SCHEMBL23009421 0.69 CYP2C19 (0.34) SMN1; SMN2
SCHEMBL10477627 0.69
SCHEMBL10477629 0.69 PPARD (0.39) SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107074859-B Cyclohexylethyl substituted diaza-and triaza-tricyclics as indoleamine-2, 3-dioxygenase (IDO) antagonists for the treatment of cancer 默克专利有限公司 2021-08-06 CN disclosed