SCHEMBL19658952

SCHEMBL19658952

NC(=O)c1nc2n(n1)CCCC2c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 18/20 0.56
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38

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
SCHEMBL22888275 0.92 RIPK1 (0.65) RIPK1
SCHEMBL18366976 0.89 RIPK1 (0.58) RIPK1PSEN1PSEN2APH1BNCSTN
SCHEMBL19659284 0.87 RIPK1 (0.56) RIPK1PSEN1PSEN2APH1BNCSTN
SCHEMBL18366974 0.84 RIPK1 (0.53) RIPK1PSEN1PSEN2APH1BNCSTN
SCHEMBL18367182 0.81 RIPK1 (0.67) RIPK1
SCHEMBL19641606 0.81 RIPK1 (0.67) RIPK1
SCHEMBL21886900 0.79 RIPK1 (0.48) RIPK1PSEN1PSEN2APH1BNCSTN
SCHEMBL22888078 0.79 RIPK1 (0.47) RIPK1PSEN1PSEN2APH1BNCSTN
SCHEMBL22209175 0.77 RIPK1 (0.63) RIPK1
SCHEMBL22209176 0.77 RIPK1 (0.63) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3760625-A1 BICYCLIC LACTAMS AS RECEPTOR-INTERACTING PROTEIN-1 (RIP1) KINASE INHIBITORS FOR TREATING E.G. INFLAMMATORY DISEASES F. Hoffmann-La Roche AG (CH) 2021-01-06 EP disclosed
WO-2017004500-A9 BICYCLIC LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-11-30 WO disclosed