SCHEMBL19207989

SCHEMBL19207989

O=C(NC1COc2cccnc2NC1=O)c1ncc(Cc2ccccc2)s1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 19/20 1.00
NPC1 O15118 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL19207987 1.00 RIPK1 (1.00) RIPK1NPC1CYP1A2CYP2C9RAB9A
SCHEMBL19228600 0.82 RIPK1 (0.70) RIPK1
SCHEMBL22509050 0.81 RIPK1 (0.69) RIPK1NPC1CYP1A2CYP2C9RAB9A
SCHEMBL19207810 0.81 RIPK1 (1.00) RIPK1
SCHEMBL19207806 0.81 RIPK1 (1.00) RIPK1
SCHEMBL19228491 0.80 RIPK1 (0.69) RIPK1
SCHEMBL21496628 0.78 RIPK1 (0.62) RIPK1NPC1
SCHEMBL21496629 0.78 RIPK1 (0.62) RIPK1NPC1
SCHEMBL19207725 0.77 RIPK1 (1.00) RIPK1CYP2C9
SCHEMBL19207726 0.77 RIPK1 (1.00) RIPK1CYP2C9

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3414239-A2 INHIBITORS OF RECEPTOR-INTERACTING PROTEIN KINASE 1 Denali Therapeutics Inc. (US) 2018-12-19 EP disclosed
WO-2017136727-A2 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. (US) 2017-08-10 WO disclosed
WO-2017136727-A2 COMPOUNDS, COMPOSITIONS AND METHODS DENALI THERAPEUTICS INC. (US) 2017-08-10 WO disclosed