SCHEMBL29529079

SCHEMBL29529079

CC(C)(C)OC(=O)N1CCOCC1c1ccc(I)cc1.[N]

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NR1H2 P55055 4/20 0.38
NR1H3 Q13133 4/20 0.38
RECQL P46063 1/20 0.37
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
MALT1 Q9UDY8 1/20 0.36
ALDH1A1 P00352 1/20 0.35
GPR119 Q8TDV5 1/20 0.35
BACE1 P56817 1/20 0.35
TMEM97 Q5BJF2 2/20 0.34
SIGMAR1 Q99720 2/20 0.34
AKR1C3 P42330 1/20 0.34
ATM Q13315 2/20 0.34

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
SCHEMBL21224528 0.99 USP2 (0.41) USP2SMN1; SMN2NR1H2NR1H3RECQL
SCHEMBL3398818 0.86 NR1H2 (0.43) USP2SMN1; SMN2NR1H2NR1H3RECQL
SCHEMBL2386023 0.86 NR1H2 (0.43) USP2SMN1; SMN2NR1H2NR1H3RECQL
SCHEMBL2386027 0.86 NR1H2 (0.43) USP2SMN1; SMN2NR1H2NR1H3RECQL
SCHEMBL21682785 0.86 NR1H2 (0.50) USP2SMN1; SMN2NR1H2NR1H3RECQL
SCHEMBL13749174 0.86 NR1H2 (0.49) USP2SMN1; SMN2NR1H2NR1H3GPR119
SCHEMBL14829403 0.86 NR1H2 (0.49) USP2SMN1; SMN2NR1H2NR1H3GPR119
SCHEMBL14829637 0.86 NR1H2 (0.49) USP2SMN1; SMN2NR1H2NR1H3GPR119
SCHEMBL14916072 0.85 CFB (0.42) USP2SMN1; SMN2NR1H2NR1H3RECQL
SCHEMBL18394698 0.85 NPC1 (0.47) USP2SMN1; SMN2NR1H2NR1H3RECQL

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-114269748-A Imidazo [1,2-c ] pyrimidine derivatives as PRC2 inhibitors for the treatment of cancer 米拉蒂医疗股份有限公司 2022-04-01 CN disclosed