SCHEMBL28873169

SCHEMBL28873169

Cc1ncc([C@@H]2CCON2C(=O)OC(C)(C)C)cc1F

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 5/20 0.39
PIK3R1 P27986 1/20 0.36
PIK3CA P42336 1/20 0.36
DPP4 P27487 1/20 0.35
GPR119 Q8TDV5 6/20 0.34
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ABL1 P00519 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
SCHEMBL22210862 1.00 RIPK1 (0.39) RIPK1PIK3R1PIK3CADPP4GPR119
SCHEMBL29966680 1.00 RIPK1 (0.39) RIPK1PIK3R1PIK3CADPP4GPR119
SCHEMBL30339166 0.91 RIPK1 (0.34) RIPK1PIK3R1PIK3CADPP4GPR119
SCHEMBL18921502 0.85 RIPK1 (0.39) RIPK1ALDH1A1ABL1
SCHEMBL30338931 0.84 RIPK1 (0.42) RIPK1PIK3R1PIK3CAGPR119
SCHEMBL29048238 0.84 RIPK1 (0.42) RIPK1PIK3R1PIK3CAGPR119
SCHEMBL30338821 0.84 RIPK1 (0.42) RIPK1PIK3R1PIK3CAGPR119
SCHEMBL29048328 0.84 RIPK1 (0.42) RIPK1PIK3R1PIK3CAGPR119
SCHEMBL18921383 0.83 RIPK1 (0.41) RIPK1ABL1
SCHEMBL22608904 0.82 NTRK1 (0.42) 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
CN-116547281-A Isoxazolidines as RIPK1 inhibitors and uses thereof 赛诺菲 2023-08-04 CN disclosed
CN-108602809-B Isoxazolidine derived inhibitors of receptor interacting protein kinase 1(RIPK 1) 戴纳立制药公司 2022-09-30 CN disclosed