SCHEMBL28243189

SCHEMBL28243189

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

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.35
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
RECQL P46063 1/20 0.34
GPR119 Q8TDV5 5/20 0.32
WNT3A P56704 1/20 0.32
HPGDS O60760 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
RIPK1 Q13546 2/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL29966499 1.00 MGLL (0.35) MGLLDDB1CRBNRECQLGPR119
SCHEMBL29966475 0.85 RIPK1 (0.34) MGLLRIPK1
SCHEMBL29966468 0.85 DDB1 (0.36) DDB1CRBNRECQLGPR119WNT3A
SCHEMBL28873141 0.85 DDB1 (0.36) DDB1CRBNRECQLGPR119WNT3A
SCHEMBL18921512 0.85 RIPK1 (0.34) MGLLRIPK1
SCHEMBL29967034 0.85 DDB1 (0.36) DDB1CRBNRECQLGPR119WNT3A
SCHEMBL18921529 0.85 DDB1 (0.36) DDB1CRBNRECQLGPR119WNT3A
SCHEMBL30547503 0.84 DGAT1 (0.39) DDB1CRBNRECQLGPR119WNT3A
SCHEMBL29048248 0.84 DGAT1 (0.39) DDB1CRBNRECQLGPR119WNT3A
SCHEMBL29966472 0.84 DGAT1 (0.39) DDB1CRBNRECQLGPR119WNT3A

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-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
CN-108602809-A Inhibitors of isoxazolidine derived receptor interacting protein kinase 1(RIPK 1) 戴纳立制药公司 2018-09-28 CN disclosed