SCHEMBL21390827

SCHEMBL21390827

CCc1cc(F)cc2nc(CCCC(=O)CC(C)(C)C(F)(F)F)n(C3CCC3)c12

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 1/20 0.30
PPARD Q03181 1/20 0.30
PPARA Q07869 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
SCHEMBL21390815 0.92 HDAC1 (0.33) JAK1
SCHEMBL21390691 0.76
SCHEMBL21390704 0.74
SCHEMBL21391078 0.73 KDM4E (0.33) JAK1
SCHEMBL21391079 0.73 CYP19A1 (0.32) JAK1
SCHEMBL21390979 0.71 HDAC1 (0.32) JAK1
SCHEMBL21390808 0.71 JAK2 (0.33) JAK1
SCHEMBL21391080 0.71 CDK4 (0.31)
SCHEMBL21390810 0.70 CYP19A1 (0.32) JAK1
SCHEMBL23132031 0.70 CYP11B2 (0.41)

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-2019183148-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KNOPP BIOSCIENCES LLC (US) 2019-09-26 WO disclosed