SCHEMBL30890578

SCHEMBL30890578

CN[C@@H](CC(C)C)C(=O)N1CC2(C[C@H]1C(N)=O)Oc1ccccc1NC2=O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ OPRM1 P35372 3/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ MAPT P10636 1/20 0.34
▸ RECQL P46063 1/20 0.32
▸ TDP1 Q9NUW8 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
SCHEMBL27245070 1.00 MEN1 (0.35) MEN1KMT2AOPRM1OPRK1MAPT
SCHEMBL30890656 0.88 OPRM1 (0.36) OPRM1OPRK1MAPT
SCHEMBL30890556 0.88 F11 (0.31) OPRM1OPRK1
SCHEMBL27244946 0.88 F11 (0.31) OPRM1OPRK1
SCHEMBL27244744 0.88 AKR1B1 (0.33) OPRM1OPRK1
Hydrochloric Acid SCHEMBL30890637 0.86 OTUD7B (0.39) MEN1KMT2AOPRM1OPRK1RECQL
Hydrochloric Acid SCHEMBL27244867 0.86 OTUD7B (0.39) MEN1KMT2AOPRM1OPRK1RECQL
SCHEMBL27244971 0.84 PLD2 (0.39) MEN1KMT2AOPRM1OPRK1MAPT
SCHEMBL30890806 0.84 PLD2 (0.39) MEN1KMT2AOPRM1OPRK1MAPT
SCHEMBL27245190 0.83 MAPT (0.32) MEN1KMT2AOPRM1OPRK1MAPT

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
EP-4612156-A1 ANTI-VIRAL COMPOUNDS Aligos Therapeutics, Inc. (US) 2025-09-10 — — EP disclosed
WO-2024097296-A1 ANTI-VIRAL COMPOUNDS ALIGOS THERAPEUTICS, INC. (US) 2024-05-10 — — WO disclosed
Send feedback