SCHEMBL30622399

SCHEMBL30622399

C=CC(=O)N1CCn2nc(-c3ccc(C#N)cc3)c(-c3ccnc4[nH]cc(C)c34)c2C1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 13/20 0.43
▸ CSNK1D P48730 3/20 0.42
▸ CSNK1E P49674 3/20 0.42
▸ LRRK2 Q5S007 1/20 0.34
▸ EGLN1 Q9GZT9 1/20 0.34
▸ BTK Q06187 1/20 0.34
▸ LIMK1 P53667 1/20 0.34
▸ LIMK2 P53671 1/20 0.34

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
SCHEMBL26644935 1.00 JAK3 (0.43) JAK3CSNK1DCSNK1ELRRK2EGLN1
SCHEMBL30622341 0.92 CSNK1D (0.46) JAK3CSNK1DCSNK1ELRRK2LIMK1
SCHEMBL26644841 0.92 CSNK1D (0.46) JAK3CSNK1DCSNK1ELRRK2LIMK1
SCHEMBL30622345 0.90 JAK3 (0.45) JAK3LRRK2BTKLIMK1
SCHEMBL26644977 0.90 JAK3 (0.45) JAK3CSNK1DCSNK1EBTK
SCHEMBL30622428 0.90 JAK3 (0.45) JAK3CSNK1DCSNK1EBTK
SCHEMBL26644982 0.90 JAK3 (0.45) JAK3LRRK2BTKLIMK1
SCHEMBL30622424 0.88 JAK3 (0.44) JAK3BTKLIMK1LIMK2
SCHEMBL26644947 0.88 JAK3 (0.44) JAK3BTKLIMK1LIMK2
SCHEMBL30622385 0.87 JAK3 (0.43) JAK3CSNK1DCSNK1EBTK

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4519265-A1 IRREVERSIBLE MUTEGFR INHIBITORS Bayer Aktiengesellschaft (DE) 2025-03-12 — — EP claimed
WO-2023213882-A1 IRREVERSIBLE MUTEGFR INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2023-11-09 — — WO claimed
EP-4519265-A1 IRREVERSIBLE MUTEGFR INHIBITORS Bayer Aktiengesellschaft (DE) 2025-03-12 — — EP disclosed
WO-2023213882-A1 IRREVERSIBLE MUTEGFR INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2023-11-09 — — WO disclosed
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