SCHEMBL19014064

SCHEMBL19014064

CN1CC2CCC(C1)N2C(=O)N1CC(C(F)(F)F)C1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 7/20 0.36
JAK1 P23458 7/20 0.36
SMN1; SMN2 Q16637 1/20 0.30
SPR P35270 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
SCHEMBL19014464 0.87 JAK2 (0.30) JAK2JAK1
SCHEMBL20682368 0.84 ATM (0.37) JAK2JAK1
SCHEMBL19014320 0.83 JAK2 (0.31) JAK2JAK1SPR
SCHEMBL19013661 0.81 GLRA1 (0.35) JAK2JAK1
SCHEMBL19014043 0.77 JAK2 (0.37) JAK2JAK1SMN1; SMN2
SCHEMBL19014178 0.77 JAK2 (0.36) JAK2JAK1
SCHEMBL19013834 0.76 JAK2 (0.39) JAK2JAK1
SCHEMBL19013716 0.75 JAK2 (0.35) JAK2JAK1
SCHEMBL19013856 0.75 JAK2 (0.35) JAK2JAK1
SCHEMBL10196653 0.74 HSD11B1 (0.33) JAK2JAK1

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
WO-2017103188-A1 THERAPEUTIC COMPOUNDS, COMPOSITIONS AND METHODS OF USE THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2017-06-22 WO disclosed