SCHEMBL19255324

SCHEMBL19255324

C#C[C@@H]1Cc2cccnc2NC(=O)[C@@H]1NC(=O)c1nnc(Cc2ccccc2)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 19/20 0.46
IDH1 O75874 1/20 0.33

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
SCHEMBL19255096 0.87 RIPK1 (0.50) RIPK1
SCHEMBL19255655 0.82 RIPK1 (0.55) RIPK1
SCHEMBL19255627 0.81 RIPK1 (0.49) RIPK1
SCHEMBL29415743 0.78 RIPK1 (0.72) RIPK1
SCHEMBL19228092 0.78 RIPK1 (0.72) RIPK1
SCHEMBL19228266 0.78 RIPK1 (0.72) RIPK1
SCHEMBL22509198 0.78 RIPK1 (0.72) RIPK1
SCHEMBL19228375 0.78 RIPK1 (0.72) RIPK1
SCHEMBL19228561 0.78 RIPK1 (0.72) RIPK1
SCHEMBL19207459 0.77 RIPK1 (0.72) RIPK1

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-2017136727-A2 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. (US) 2017-08-10 WO disclosed