SCHEMBL29157619

SCHEMBL29157619

CC(C)[C@H](N)C(=O)Nc1nc(O)nc2[nH]cnc12

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CIT O14578 1/20 0.37
▸ ROCK2 O75116 2/20 0.36

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
SCHEMBL16146678 0.79 GDA (0.39) —
SCHEMBL29278769 0.76 SPHK1 (0.32) —
SCHEMBL29184339 0.74 SPHK1 (0.36) CIT
SCHEMBL19738205 0.72 SYK (0.39) —
SCHEMBL130810 0.72 XDH (0.38) —
SCHEMBL16146571 0.71 SLC29A1 (0.39) —
SCHEMBL16146383 0.69 PGK1 (0.36) —
SCHEMBL19699540 0.69 GSK3B (0.38) —
SCHEMBL28688018 0.69 — —
SCHEMBL16145765 0.69 SLC29A1 (0.42) —

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-117597144-A Immunogenic compositions against influenza 辉瑞公司 2024-02-23 — — CN disclosed
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