SCHEMBL19255682

SCHEMBL19255682

C#C[C@@H]1Cc2nccnc2N(C)C(=O)[C@@H]1NC(=O)c1nnc(Cc2ccccc2)s1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 20/20 0.65

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
SCHEMBL19255664 0.89 RIPK1 (0.68) RIPK1
SCHEMBL19255749 0.83 RIPK1 (0.47) RIPK1
SCHEMBL19224458 0.80 RIPK1 (0.68) RIPK1
SCHEMBL19255557 0.80 RIPK1 (0.67) RIPK1
SCHEMBL19207891 0.79 RIPK1 (1.00) RIPK1
SCHEMBL19228567 0.79 RIPK1 (1.00) RIPK1
SCHEMBL19207530 0.79 RIPK1 (1.00) RIPK1
SCHEMBL19880650 0.79 RIPK1 (1.00) RIPK1
SCHEMBL19207890 0.79 RIPK1 (1.00) RIPK1
SCHEMBL19805527 0.79 RIPK1 (1.00) 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