SCHEMBL30361395

SCHEMBL30361395

Nc1ncnc2occ(-c3ccc4c(c3)CCN4C(=O)Cc3cc(F)ccc3F)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EIF2AK3 Q9NZJ5 18/20 1.00
▸ RIPK1 Q13546 1/20 0.50
▸ EIF2AK2 P19525 2/20 0.48
▸ EIF2AK1 Q9BQI3 1/20 0.48

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
SCHEMBL869204 1.00 EIF2AK3 (1.00) EIF2AK3RIPK1EIF2AK2EIF2AK1
SCHEMBL869562 0.87 EIF2AK3 (1.00) EIF2AK3RIPK1EIF2AK1
SCHEMBL869310 0.85 EIF2AK3 (0.75) EIF2AK3RIPK1EIF2AK2EIF2AK1
SCHEMBL868645 0.85 EIF2AK3 (0.74) EIF2AK3RIPK1EIF2AK2
SCHEMBL869091 0.85 EIF2AK3 (0.74) EIF2AK3RIPK1EIF2AK2EIF2AK1
SCHEMBL869888 0.85 EIF2AK3 (0.74) EIF2AK3RIPK1EIF2AK2EIF2AK1
SCHEMBL868994 0.84 EIF2AK3 (0.73) EIF2AK3RIPK1EIF2AK2EIF2AK1
SCHEMBL868836 0.84 EIF2AK3 (1.00) EIF2AK3RIPK1EIF2AK1
SCHEMBL869218 0.83 EIF2AK3 (0.72) EIF2AK3RIPK1EIF2AK2EIF2AK1
SCHEMBL868634 0.83 EIF2AK3 (1.00) EIF2AK3RIPK1EIF2AK2EIF2AK1

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
US-20230137667-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CORONAVIRUS INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-04 — — US claimed
US-20230137667-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF CORONAVIRUS INFECTION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-04 — — US disclosed
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