SCHEMBL19687592

SCHEMBL19687592

Cc1ccc2c(cc(C#N)n2Cc2ccn(C)n2)c1C

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 9/20 0.39
PARG Q86W56 5/20 0.38
RAB9A P51151 1/20 0.36
BRD4 O60885 1/20 0.36
GRIN2B Q13224 5/20 0.35
GRIN1 Q05586 4/20 0.35

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) PARGGRIN2BGRIN1
SCHEMBL19687584 0.77 PARG (0.39) KCNH2PARGRAB9A
SCHEMBL19687595 0.73 MEN1 (0.45) PARGRAB9AGRIN2BGRIN1
SCHEMBL19687589 0.73 PARG (0.35) PARGRAB9AGRIN2BGRIN1
SCHEMBL19687588 0.73 PARG (0.40) PARG
SCHEMBL19687591 0.73 MEN1 (0.43) RAB9A
SCHEMBL19687593 0.73 POLB (0.41) PARGRAB9A
SCHEMBL19687582 0.72 PARG (0.35) PARGRAB9AGRIN2BGRIN1
SCHEMBL19687576 0.71 RAB9A (0.35) RAB9A
SCHEMBL19687598 0.71 RAB9A (0.35) RAB9A

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