SCHEMBL19567167

SCHEMBL19567167

N#CC[C@H]1CC[C@H](NC2CC(F)(F)C2)CC1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.31

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
SCHEMBL19568015 0.86 KMT2A (0.31) KMT2A
SCHEMBL26275171 0.77 ALDH1A1 (0.50) KMT2A
SCHEMBL19567369 0.74 JAK2 (0.34) KMT2A
SCHEMBL24093055 0.74 JAK2 (0.34) KMT2A
SCHEMBL19567362 0.74 JAK2 (0.34) KMT2A
SCHEMBL2306469 0.74
SCHEMBL19567179 0.71
SCHEMBL19567846 0.71
SCHEMBL13907209 0.71 JAK2 (0.33) KMT2A
SCHEMBL2162286 0.71 JAK2 (0.33) KMT2A

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-2017191098-A1 PYRAZOLE DERIVATIVES, COMPOSITIONS AND THERAPEUTIC USE THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2017-11-09 WO disclosed