SCHEMBL25323286

SCHEMBL25323286

FC(F)(F)C1CCCC(c2ccccc2)=N1.FC(F)(F)C1CCCC(c2ccccc2)N1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NOS3 P29474 1/20 0.35
▸ NOS1 P29475 1/20 0.35
▸ NOS2 P35228 1/20 0.35
▸ GRIN2B Q13224 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ P2RX7 Q99572 2/20 0.30
▸ CHRNB4 P30926 1/20 0.30
▸ CHRNA3 P32297 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
SCHEMBL25323166 0.82 NOS1 (0.49) NOS3NOS1NOS2KDM4EMAPT
SCHEMBL25323163 0.82 NOS1 (0.49) NOS3NOS1NOS2KDM4EMAPT
SCHEMBL25920105 0.82 NOS1 (0.49) NOS3NOS1NOS2KDM4EMAPT
SCHEMBL25321059 0.81 MEN1 (0.41) GRIN2BKDM4EMEN1KMT2A
SCHEMBL30551331 0.81 MEN1 (0.41) GRIN2BKDM4EMEN1KMT2A
SCHEMBL25920106 0.81 MEN1 (0.41) GRIN2BKDM4EMEN1KMT2A
Trifluoroacetic Acid SCHEMBL25325870 0.75 NOS3 (0.41) NOS3NOS1NOS2CHRNB4CHRNA3
SCHEMBL14065400 0.68 MEN1 (0.47) MEN1KMT2A
SCHEMBL6924404 0.68 MEN1 (0.47) MEN1KMT2A
SCHEMBL4865057 0.68 MEN1 (0.47) MEN1KMT2A

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
WO-2023146990-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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