SCHEMBL30622795

SCHEMBL30622795

Cc1c[nH]c2nccc(-c3c(-c4ccc(F)cc4)nn4c3CN(C(=O)OC(C)(C)C)CC4)c12

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CSNK1E P49674 9/20 0.42
▸ CSNK1D P48730 6/20 0.42
▸ CDK9 P50750 3/20 0.40
▸ CCNT1 O60563 2/20 0.40
▸ GRIA1 P42261 1/20 0.38
▸ BTK Q06187 1/20 0.38
▸ SLC34A1 Q06495 2/20 0.37
▸ SQOR Q9Y6N5 1/20 0.37
▸ ALK Q9UM73 1/20 0.35
▸ AKT1 P31749 1/20 0.35
▸ AKT1S1 Q96B36 1/20 0.35

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
SCHEMBL26645523 1.00 CSNK1E (0.42) CSNK1ECSNK1DCDK9CCNT1GRIA1
SCHEMBL30623060 0.89 CCNT1 (0.43) CSNK1ECSNK1DCDK9CCNT1BTK
SCHEMBL30622428 0.86 JAK3 (0.45) CSNK1ECSNK1DBTKAKT1AKT1S1
SCHEMBL26644977 0.86 JAK3 (0.45) CSNK1ECSNK1DBTKAKT1AKT1S1
SCHEMBL30622798 0.85 CSNK1D (0.46) CSNK1ECSNK1DCDK9CCNT1GRIA1
SCHEMBL26645620 0.85 CSNK1D (0.46) CSNK1ECSNK1DCDK9CCNT1GRIA1
SCHEMBL30622780 0.85 CDK9 (0.34) CDK9CCNT1GRIA1BTKSLC34A1
SCHEMBL26645177 0.85 BTK (0.40) CDK9CCNT1BTKALK
SCHEMBL30622787 0.85 BTK (0.40) CDK9CCNT1BTKALK
SCHEMBL30623143 0.85 CSNK1E (0.48) CSNK1ECSNK1DBTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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