SCHEMBL24708127

SCHEMBL24708127

Nc1ccnc(OC2COCC2O)n1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 2/20 0.38
▸ SCN9A Q15858 1/20 0.37
▸ FEN1 P39748 7/20 0.36
▸ ALOX5AP P20292 6/20 0.36
▸ PDE2A O00408 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ DCK P27707 1/20 0.31
▸ MKNK2 Q9HBH9 6/20 0.31
▸ SYK P43405 1/20 0.30

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
SCHEMBL30856787 1.00 ABL1 (0.38) ABL1SCN9AFEN1ALOX5APPDE2A
SCHEMBL24708126 0.77 SCN9A (0.33) SCN9AFEN1ALOX5APDCK
SCHEMBL30856733 0.77 SCN9A (0.33) SCN9AFEN1ALOX5APDCK
SCHEMBL18983023 0.73 MKNK2 (0.41) PDE2APDE10AMKNK2
SCHEMBL16801919 0.73 MKNK2 (0.41) PDE2APDE10AMKNK2
SCHEMBL18983025 0.73 MKNK2 (0.41) PDE2APDE10AMKNK2
SCHEMBL16801745 0.73 MKNK2 (0.41) PDE2APDE10AMKNK2
SCHEMBL16801342 0.73 MKNK2 (0.41) PDE2APDE10AMKNK2
SCHEMBL14881383 0.72 LRRK2 (0.46) SCN9ADCK
SCHEMBL14879950 0.72 LRRK2 (0.46) SCN9ADCK

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
CN-117813302-A Substituted tetrahydrofuran-2-carboxamides as sodium channel modulators 沃泰克斯药物股份有限公司 2024-04-02 — — CN disclosed
WO-2022256702-A1 SUBSTITUTED TETRAHYDROFURAN-2-CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2022-12-08 — — WO disclosed
Send feedback