SCHEMBL21390819

SCHEMBL21390819

Cc1c(C2(O)CCC2)ccc2nc(CCCCC(=O)CC(C)(C)C)n(C3CCC3)c12

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.32
JAK1 P23458 1/20 0.31
RORC P51449 1/20 0.30
HDAC1 Q13547 2/20 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
SCHEMBL21390870 0.89 JAK1 (0.30) JAK1
SCHEMBL21391098 0.87 JAK1 (0.31) CNR2JAK1
SCHEMBL21390924 0.76 HTR3A (0.34) JAK1
SCHEMBL21390810 0.76 CYP19A1 (0.32) JAK1RORCHDAC1
SCHEMBL21391086 0.75 AR (0.33) JAK1HDAC1
SCHEMBL21390979 0.75 HDAC1 (0.32) JAK1HDAC1
SCHEMBL21390787 0.75 RORC (0.30) RORCHDAC1
SCHEMBL21391159 0.75 SMN1; SMN2 (0.35) HDAC1
SCHEMBL23132031 0.74 CYP11B2 (0.41) HDAC1
SCHEMBL21390892 0.73 KDM4E (0.33) JAK1

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