SCHEMBL29068686

SCHEMBL29068686

CC(C)(C)OC(=O)N1C=CC=NN1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
BCHE P06276 1/20 0.31
NR1H2 P55055 1/20 0.31
FAAH O00519 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL29070731 0.77 LPO (0.34)
SCHEMBL28034490 0.73 USP2 (0.34) USP2SMN1; SMN2BCHENR1H2CHRM2
SCHEMBL3992615 0.71
SCHEMBL28626925 0.68 USP2 (0.34) USP2SMN1; SMN2BCHENR1H2CHRM2
SCHEMBL5753658 0.66 USP2 (0.35) USP2SMN1; SMN2BCHENR1H2CHRM2
SCHEMBL27727462 0.66 BCHE (0.34) USP2SMN1; SMN2BCHEFAAHCHRM2
SCHEMBL1615448 0.66 USP2 (0.32) USP2SMN1; SMN2BCHEFAAHCHRM2
SCHEMBL1616176 0.64 USP2 (0.34) USP2SMN1; SMN2BCHE
SCHEMBL29250309 0.64 USP2 (0.42) USP2SMN1; SMN2BCHENR1H2FAAH
SCHEMBL15300153 0.63 FAAH (0.32) USP2SMN1; SMN2FAAHCHRM2CHRM1

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-116745292-A Substituted pyridotriazine compounds and uses thereof 吉利德科学公司 2023-09-12 CN disclosed