SCHEMBL30215935

SCHEMBL30215935

Cc1cc(-c2cnc3[nH]cc(-c4ccc(C(=O)N(C)C[C@H](C)O[Si](C)(C)C(C)(C)C)cc4)c3n2)cc2c1CN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 7/20 0.58
▸ MAP3K5 Q99683 3/20 0.35
▸ GPR119 Q8TDV5 5/20 0.34
▸ GCK P35557 1/20 0.32
▸ ROCK2 O75116 1/20 0.32
▸ SYK P43405 1/20 0.32
▸ PRKCI P41743 1/20 0.32

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
SCHEMBL24954419 1.00 MAP4K1 (0.58) MAP4K1MAP3K5GPR119GCKROCK2
SCHEMBL30215949 0.89 MAP4K1 (0.51) MAP4K1
SCHEMBL24954352 0.89 MAP4K1 (0.51) MAP4K1
SCHEMBL30215947 0.84 MAP4K1 (0.70) MAP4K1MAP3K5GPR119ROCK2
SCHEMBL30893063 0.84 MAP4K1 (0.70) MAP4K1MAP3K5GPR119ROCK2
SCHEMBL24954299 0.84 MAP4K1 (0.70) MAP4K1MAP3K5GPR119ROCK2
SCHEMBL24954322 0.81 MAP4K1 (0.71) MAP4K1SYK
SCHEMBL24954323 0.81 MAP4K1 (0.71) MAP4K1SYK
SCHEMBL24954367 0.77 MAP4K1 (0.58) MAP4K1GPR119
SCHEMBL24954508 0.77 MAP4K1 (0.76) MAP4K1

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-4377318-A1 PYRROLO [2, 3-B] PYRAZINE-BASED BIFUNCTIONAL COMPOUNDS AS HPK1 DEGRADERS AND THE USE THEREOF BeiGene, Ltd. (KY) 2024-06-05 — — EP disclosed
CN-118043324-A Pyrrolo [2,3-b ] pyrazine-based bifunctional compounds as HPK1 degradants and uses thereof 百济神州有限公司 2024-05-14 — — CN disclosed
WO-2023006063-A1 PYRROLO [2, 3-b] PYRAZINE-BASED BIFUNCTIONAL COMPOUNDS AS HPK1 DEGRADERS AND THE USE THEREOF BEIGENE, LTD. (KY) 2023-02-02 — — WO disclosed
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