SCHEMBL19687589

SCHEMBL19687589

Cc1ccc2c(cc(C#N)n2Cc2nonc2C)c1C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 1/20 0.35
RAB9A P51151 1/20 0.32
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 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
SCHEMBL19687574 0.79 PARG (0.40) PARGGRIN1GRIN2B
SCHEMBL19687588 0.78 PARG (0.40) PARG
SCHEMBL19687582 0.77 PARG (0.35) PARGRAB9AGRIN1GRIN2B
SCHEMBL19687584 0.77 PARG (0.39) PARGRAB9A
SCHEMBL19687595 0.73 MEN1 (0.45) PARGRAB9AGRIN1GRIN2B
SCHEMBL19687598 0.71 RAB9A (0.35) RAB9A
SCHEMBL19687576 0.71 RAB9A (0.35) RAB9A
SCHEMBL19687591 0.70 MEN1 (0.43) RAB9A
SCHEMBL19687583 0.69 MEN1 (0.43) RAB9A
SCHEMBL19687586 0.69 MEN1 (0.46)

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-2017205972-A1 SYSTEMS METHODS AND COMPOSITIONS FOR PREDICTING METASTASIS IN BLADDER CANCER GENOMEDX BIOSCIENCES, INC. (CA) 2017-12-07 WO disclosed