SCHEMBL31306767

SCHEMBL31306767

CC(C)(C)OC(=O)N1CCC2(CC1)CC(n1cc([N+](=O)[O-])cn1)C2

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ DDB1 Q16531 1/20 0.42
▸ CRBN Q96SW2 1/20 0.42
▸ GPR119 Q8TDV5 6/20 0.42
▸ NAMPT P43490 4/20 0.42
▸ ACACB O00763 4/20 0.39
▸ CYP11B2 P19099 1/20 0.38
▸ KCNH2 Q12809 1/20 0.38

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
SCHEMBL27035020 0.89 ALDH1A1 (0.43) ALDH1A1LMNAMAPTDDB1CRBN
SCHEMBL1558660 0.86 DDB1 (0.52) ALDH1A1LMNAMAPTDDB1CRBN
SCHEMBL30984829 0.84 GPR119 (0.45) ALDH1A1LMNAMAPTDDB1CRBN
SCHEMBL16423801 0.83 ALDH1A1 (0.47) ALDH1A1LMNAMAPTDDB1CRBN
SCHEMBL31306762 0.83 DDB1 (0.45) DDB1CRBNGPR119NAMPTACACB
SCHEMBL26981235 0.83 DDB1 (0.45) DDB1CRBNGPR119NAMPTACACB
SCHEMBL14662465 0.83 DDB1 (0.45) DDB1CRBNGPR119NAMPTACACB
SCHEMBL30955791 0.82 DDB1 (0.49) ALDH1A1LMNAMAPTDDB1CRBN
SCHEMBL22587586 0.82 ALDH1A1 (0.50) ALDH1A1LMNAMAPTDDB1CRBN
SCHEMBL30955756 0.82 DDB1 (0.49) ALDH1A1LMNAMAPTDDB1CRBN

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-119431366-A IRAK4 degradation agent compound and application thereof 江苏先声药业有限公司 2025-02-14 — — CN disclosed
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