SCHEMBL19207670

SCHEMBL19207670

CN1C(=O)C(NC(=O)O)CC(=O)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.47
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
PYGL P06737 2/20 0.44
PYGM P11217 2/20 0.44
CCKBR P32239 10/20 0.44
CCKAR P32238 1/20 0.43
PSEN1 P49768 2/20 0.42
PSEN2 P49810 2/20 0.42
APH1B Q8WW43 2/20 0.42
NCSTN Q92542 2/20 0.42
APH1A Q96BI3 2/20 0.42
PSENEN Q9NZ42 2/20 0.42
NOTUM Q6P988 1/20 0.41

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
SCHEMBL19207822 0.83 SCN9A (0.47) CCKBRCCKAR
SCHEMBL7819630 0.83 SCN9A (0.47) CCKBRCCKAR
SCHEMBL15964676 0.82 SCN9A (0.50) RIPK1ALDH1A1
SCHEMBL15956793 0.77 RIPK1 (0.57) RIPK1PYGLPYGMCCKBR
SCHEMBL5396473 0.76 RIPK1 (0.48) RIPK1PYGLPYGMCCKBR
SCHEMBL17321316 0.76 RIPK1 (0.83) RIPK1
SCHEMBL3924251 0.75 RIPK1 (0.63) RIPK1PYGLPYGMCCKBRPSEN1
SCHEMBL4218830 0.75 RIPK1 (0.63) RIPK1PYGLPYGMCCKBRPSEN1
SCHEMBL4852198 0.74 PSEN1 (0.43) KDM4EALDH1A1HPGDCCKBRCCKAR
SCHEMBL4191956 0.74 RIPK1 (0.60) RIPK1PYGLPYGM

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-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