SCHEMBL28873141

SCHEMBL28873141

CC(C)(C)OC(=O)N1OCC[C@H]1c1ccc(F)nc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
RIPK1 Q13546 3/20 0.35
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
GPR119 Q8TDV5 5/20 0.33
WNT3A P56704 1/20 0.33
KDM1A O60341 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33
RECQL P46063 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
SCHEMBL18921529 1.00 DDB1 (0.36) DDB1CRBNRIPK1JAK2JAK1
SCHEMBL29966468 1.00 DDB1 (0.36) DDB1CRBNRIPK1JAK2JAK1
SCHEMBL29967034 1.00 DDB1 (0.36) DDB1CRBNRIPK1JAK2JAK1
SCHEMBL29048248 0.87 DGAT1 (0.39) DDB1CRBNGPR119WNT3ARECQL
SCHEMBL29966472 0.87 DGAT1 (0.39) DDB1CRBNGPR119WNT3ARECQL
SCHEMBL18921328 0.87 DGAT1 (0.39) DDB1CRBNGPR119WNT3ARECQL
SCHEMBL30547503 0.87 DGAT1 (0.39) DDB1CRBNGPR119WNT3ARECQL
SCHEMBL25816413 0.86 TSHR (0.37) DDB1CRBNRIPK1
SCHEMBL28243189 0.85 MGLL (0.35) DDB1CRBNRIPK1GPR119WNT3A
SCHEMBL29966499 0.85 MGLL (0.35) DDB1CRBNRIPK1GPR119WNT3A

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
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