SCHEMBL31672355

SCHEMBL31672355

CN(C)C/C=C/C(=O)N1CCN(C(=O)c2cc(O)cc(Cl)c2-c2ccccc2Cl)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CDK14 O94921 2/20 0.39
▸ CCNY Q8ND76 2/20 0.39
▸ RAB9A P51151 2/20 0.38
▸ EGFR P00533 3/20 0.38
▸ BTK Q06187 4/20 0.37
▸ F2R P25116 1/20 0.37
▸ TXK P42681 1/20 0.37
▸ ITK Q08881 1/20 0.37
▸ JAK3 P52333 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CCNK O75909 2/20 0.36
▸ CDK12 Q9NYV4 2/20 0.36
▸ GAA P10253 1/20 0.35
▸ KRAS P01116 1/20 0.35
▸ ABL1 P00519 1/20 0.35
▸ RIN1 Q13671 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
SCHEMBL17608793 1.00 MAPT (0.41) MAPTL3MBTL1CDK14CCNYRAB9A
SCHEMBL17608791 1.00 MAPT (0.41) MAPTL3MBTL1CDK14CCNYRAB9A
SCHEMBL17800784 0.87 BTK (0.40) MAPTL3MBTL1CDK14CCNYRAB9A
SCHEMBL17800783 0.87 BTK (0.40) MAPTL3MBTL1CDK14CCNYRAB9A
SCHEMBL31672378 0.87 BTK (0.40) MAPTL3MBTL1CDK14CCNYRAB9A
SCHEMBL31672384 0.83 RAB9A (0.44) RAB9ABTKKMT2AGAAKRAS
SCHEMBL17608599 0.83 RAB9A (0.44) RAB9ABTKKMT2AGAAKRAS
SCHEMBL16100491 0.83 MAPT (0.42) MAPTL3MBTL1CDK14CCNYRAB9A
SCHEMBL16100490 0.83 MAPT (0.42) MAPTL3MBTL1CDK14CCNYRAB9A
SCHEMBL16102029 0.78 TXK (0.48) MAPTL3MBTL1RAB9ABTKTXK

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
US-RE50527-E1 Covalent inhibitors of KRAS G12C ARAXES PHARMA LLC (US) 2025-08-12 — — US disclosed
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