SCHEMBL30890744

SCHEMBL30890744

CC(C)(C)OC(=O)N1C[C@@]2(C[C@H]1C(N)=O)Oc1ccc(F)cc1NC2=O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 4/20 0.35
▸ AKR1B10 O60218 1/20 0.35
▸ AKR1A1 P14550 1/20 0.35
▸ NR1H2 P55055 6/20 0.34
▸ NR1H3 Q13133 5/20 0.34
▸ RXRA P19793 4/20 0.34
▸ PAK1 Q13153 1/20 0.33
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ IMPDH2 P12268 3/20 0.32
▸ BACE1 P56817 3/20 0.31
▸ BACE2 Q9Y5Z0 2/20 0.31

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
SCHEMBL30890482 0.87 POLB (0.40) NR1H2NR1H3RXRAPOLBHSD17B10
SCHEMBL27244767 0.85 AKR1B1 (0.39) AKR1B1AKR1B10AKR1A1MAOAMAOB
SCHEMBL30890780 0.84 MAOB (0.34) AKR1B1AKR1B10AKR1A1MAOAMAOB
SCHEMBL30992283 0.83 CCNB2 (0.36) NR1H2NR1H3RXRAIMPDH2BACE1
SCHEMBL30890800 0.83 IMPDH2 (0.30) IMPDH2
SCHEMBL30890432 0.82 — —
SCHEMBL30890471 0.81 NR1H2 (0.41) NR1H2NR1H3RXRA
SCHEMBL30890440 0.80 NR1H2 (0.35) NR1H2NR1H3RXRAIMPDH2
SCHEMBL30992270 0.80 USP30 (0.34) —
SCHEMBL30890399 0.80 AR (0.32) NR1H2NR1H3

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 3 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
US-20240199647-A1 ANTI-VIRAL COMPOUNDS KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2024-06-20 — — US disclosed
WO-2024097296-A1 ANTI-VIRAL COMPOUNDS ALIGOS THERAPEUTICS, INC. (US) 2024-05-10 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240199647-A1 ANTI-VIRAL COMPOUNDS EIF2AK2, ZC3HAV1, HAVCR2 AKR1B1 3356/4885AKR1B10 3482/4885AKR1A1 3324/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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