SCHEMBL10278532

SCHEMBL10278532

CC(C)[C@@H]1CCC[C@H](c2ccncc2NC(=O)c2ccc(F)c(-c3c(F)cc(S(C)(=O)=O)cc3F)n2)O1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 20/20 0.53
PIM3 Q86V86 20/20 0.53
PIM2 Q9P1W9 20/20 0.53

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
SCHEMBL10278522 0.89 PIM1 (0.63) PIM1PIM3PIM2
SCHEMBL14891348 0.88 PIM1 (0.57) PIM1PIM3PIM2
SCHEMBL10278521 0.88 PIM1 (0.57) PIM1PIM3PIM2
SCHEMBL14891346 0.88 PIM1 (0.57) PIM1PIM3PIM2
SCHEMBL14892481 0.88 PIM1 (0.57) PIM1PIM3PIM2
SCHEMBL14891660 0.82 PIM2 (0.58) PIM1PIM3PIM2
SCHEMBL14906109 0.82 PIM2 (0.58) PIM1PIM3PIM2
SCHEMBL14891604 0.79 PIM2 (0.58) PIM1PIM3PIM2
SCHEMBL14906135 0.79 PIM1 (0.56) PIM1PIM3PIM2
SCHEMBL14906207 0.78 PIM1 (0.53) PIM1PIM3PIM2

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-2012004217-A1 CYCLIC ETHER COMPOUNDS USEFUL AS KINASE INHIBITORS NOVARTIS AG (CH) 2012-01-12 WO disclosed