SCHEMBL30001151

SCHEMBL30001151

CC(C)(O[Si](C)(C)C)c1cc(N)ccn1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ASIC3 Q9UHC3 1/20 0.35
▸ NOS3 P29474 2/20 0.32
▸ NOS1 P29475 2/20 0.32
▸ NOS2 P35228 2/20 0.32
▸ NUDT1 P36639 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PRKCI P41743 1/20 0.31
▸ LOXL2 Q9Y4K0 1/20 0.30
▸ HSD17B10 Q99714 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
SCHEMBL24706908 1.00 ASIC3 (0.35) ASIC3NOS3NOS1NOS2NUDT1
SCHEMBL30573717 0.78 PRKCI (0.44) ASIC3NOS3NOS1NOS2KDM4E
SCHEMBL3992526 0.78 PRKCI (0.44) ASIC3NOS3NOS1NOS2KDM4E
SCHEMBL20299141 0.78 KDM4E (0.35) KDM4E
SCHEMBL15102663 0.75 ASIC3 (0.38) ASIC3NOS3NOS1NOS2KDM4E
SCHEMBL30505883 0.75 LOXL2 (0.40) ASIC3NOS3NOS1NOS2KDM4E
SCHEMBL16094673 0.75 LOXL2 (0.40) ASIC3NOS3NOS1NOS2KDM4E
SCHEMBL23916448 0.74 ENPP2 (0.33) —
Hydrochloric Acid SCHEMBL28398282 0.73 ASIC3 (0.37) ASIC3NOS3NOS1NOS2KDM4E
SCHEMBL24706940 0.72 LOXL2 (0.30) LOXL2

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-4347032-A1 SUBSTITUTED TETRAHYDROFURAN-2-CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS Vertex Pharmaceuticals Incorporated (US) 2024-04-10 — — EP disclosed
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
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