SCHEMBL30137630

SCHEMBL30137630

C[C@@H]1CNC(=O)c2cc3ccc(C(=O)Nc4ccc(-c5cnn(C)c5)cc4OC(F)F)nc3n21

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ RPS6KA3 P51812 19/20 0.54
▸ RPS6KA2 Q15349 4/20 0.52
▸ RPS6KA1 Q15418 1/20 0.51
▸ RPS6KA6 Q9UK32 1/20 0.51

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
SCHEMBL30137592 0.90 RPS6KA3 (0.52) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137601 0.89 RPS6KA3 (0.54) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137564 0.85 RPS6KA3 (0.57) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137577 0.85 RPS6KA3 (0.64) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137572 0.85 RPS6KA3 (0.52) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137593 0.84 RPS6KA3 (0.55) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137566 0.84 RPS6KA3 (0.56) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137578 0.83 RPS6KA3 (0.58) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137625 0.83 RPS6KA3 (0.55) RPS6KA3RPS6KA2RPS6KA1RPS6KA6
SCHEMBL30137643 0.81 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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