SCHEMBL30137577

SCHEMBL30137577

C[C@@H]1CNC(=O)c2cc3ccc(C(=O)Nc4ccccc4OC(F)F)nc3n21

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ RPS6KA3 P51812 20/20 0.64
▸ RPS6KA2 Q15349 2/20 0.55
▸ RPS6KA1 Q15418 1/20 0.53
▸ RPS6KA6 Q9UK32 1/20 0.53

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
SCHEMBL30137564 0.90 RPS6KA3 (0.57) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137593 0.88 RPS6KA3 (0.55) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137625 0.86 RPS6KA3 (0.55) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137630 0.85 RPS6KA3 (0.54) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137627 0.85 RPS6KA3 (0.54) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137498 0.85 RPS6KA3 (0.54) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137541 0.84 RPS6KA3 (0.51) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137538 0.84 RPS6KA3 (0.51) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137552 0.84 RPS6KA3 (0.51) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137611 0.84 RPS6KA3 (0.53) RPS6KA3RPS6KA2RPS6KA1RPS6KA6

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-115611897-A Compounds as RSK2 inhibitors and uses thereof 南京圣和药业股份有限公司 2023-01-17 — — CN disclosed
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