SCHEMBL936747

SCHEMBL936747

CC(C#N)NC(=O)c1cccc(-c2cc(-c3ccc(N4CCN(C)CC4)c(Cl)c3)[nH]n2)c1

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PRKD1 Q15139 20/20 0.68

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
SCHEMBL1056933 1.00 PRKD1 (0.68) PRKD1
SCHEMBL6922426 0.91 PRKD1 (0.82) PRKD1
SCHEMBL6924025 0.90 PRKD1 (0.55) PRKD1
SCHEMBL6922259 0.88 PRKD1 (0.84) PRKD1
SCHEMBL936126 0.88 PRKD1 (0.81) PRKD1
SCHEMBL1059135 0.87 PRKD1 (0.73) PRKD1
SCHEMBL6922942 0.87 PRKD1 (0.72) PRKD1
SCHEMBL936340 0.86 PRKD1 (0.83) PRKD1
SCHEMBL6924016 0.86 PRKD1 (0.67) PRKD1
SCHEMBL6924033 0.85 PRKD1 (0.64) PRKD1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011009484-A1 ARYLPYRAZOLES AND ARYLISOXAZOLES AND THEIR USE AS PKD MODULATORS NOVARTIS AG (CH) 2011-01-27 WO disclosed
WO-2011009484-A1 ARYLPYRAZOLES AND ARYLISOXAZOLES AND THEIR USE AS PKD MODULATORS NOVARTIS AG (CH) 2011-01-27 WO disclosed