SCHEMBL21390888

SCHEMBL21390888

Cc1c(OC(F)F)ccc2nc(NC(=O)CC(C)(O)c3ccccc3)n(C3(C)CCC3)c12

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 3/20 0.31
CYP3A4 P08684 2/20 0.31
HCRTR2 O43614 1/20 0.31
KCNA5 P22460 1/20 0.30
KCNH2 Q12809 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
SCHEMBL30315769 0.92 ACSS2 (0.32)
SCHEMBL21354736 0.92 ACSS2 (0.32)
SCHEMBL18791929 0.84 ACSS2 (0.38)
SCHEMBL20111113 0.84 ACSS2 (0.38)
SCHEMBL18791928 0.84 ACSS2 (0.38)
SCHEMBL19278076 0.83 LMNA (0.32) HCRTR2
SCHEMBL19278082 0.83 LMNA (0.32) HCRTR2
SCHEMBL18791653 0.82 ACSS2 (0.35)
SCHEMBL20111100 0.82 ACSS2 (0.35)
SCHEMBL21390812 0.82 PDE4A (0.30) HCRTR2

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