SCHEMBL3959784

SCHEMBL3959784

NNC(=O)c1ccc(F)nc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
GFER P55789 2/20 0.43
KDM4E B2RXH2 4/20 0.42
MAPT P10636 3/20 0.42
GAA P10253 3/20 0.41
MEN1 O00255 1/20 0.41
MITF O75030 1/20 0.41
KMT2A Q03164 1/20 0.41
NCOA1 Q15788 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NCOA3 Q9Y6Q9 1/20 0.41
P2RX7 Q99572 5/20 0.40
MPO P05164 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP1A2 P05177 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2A6 P11509 1/20 0.38
CYP2C19 P33261 1/20 0.38
CTSD P07339 2/20 0.37

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
SCHEMBL30934037 0.78 ALDH1A1 (0.43) ALDH1A1
SCHEMBL447058 0.78 ALDH1A1 (0.43) ALDH1A1
SCHEMBL2762235 0.78 DGAT1 (0.42) ALDH1A1KDM4EMAPTGAAMEN1
SCHEMBL30641935 0.78 DGAT1 (0.42) ALDH1A1KDM4EMAPTGAAMEN1
SCHEMBL29551348 0.75 NAPRT (0.50) ALDH1A1KDM4ETDP1CYP1A2CA1
SCHEMBL445478 0.75 NAPRT (0.50) ALDH1A1KDM4ETDP1CYP1A2CA1
SCHEMBL30506330 0.74 SMN1; SMN2 (0.40) ALDH1A1KDM4EMAPTGAAMEN1
SCHEMBL3160278 0.74 SMN1; SMN2 (0.40) ALDH1A1KDM4EMAPTGAAMEN1
Hydrochloric Acid SCHEMBL2211447 0.74 NAPRT (0.48) ALDH1A1KDM4ETDP1CYP1A2CA1
SCHEMBL23067217 0.73 CTSA (0.47) ALDH1A1GFERKDM4EMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4658074-A1 FUNGICIDAL COMPOSITIONS Syngenta Crop Protection AG (CH) 2025-12-10 EP disclosed
EP-4655284-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES Syngenta Crop Protection AG (CH) 2025-12-03 EP disclosed
EP-4626232-A1 FUNGICIDAL COMPOSITIONS Syngenta Crop Protection AG (CH) 2025-10-08 EP disclosed
EP-4619396-A1 MICROBIOCIDAL TETRAHYDROISOQUINOLINE DERIVATIVES Syngenta Crop Protection AG (CH) 2025-09-24 EP disclosed
WO-2024160801-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2024-08-08 WO disclosed
WO-2024156886-A1 MICROBIOCIDAL PYRAZOLE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2024-08-02 WO disclosed
WO-2024115546-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2024-06-06 WO disclosed
WO-2024115546-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2024-06-06 WO disclosed
WO-2024105104-A1 MICROBIOCIDAL TETRAHYDROISOQUINOLINE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2024-05-23 WO disclosed
CN-101553486-A Oxadiazole and thiadiazole compounds and their use as nicotinic acetylcholine receptor modulators NEUROSEARCH AS (DK) 2009-10-07 CN disclosed
EP-2079734-A1 OXADIAZOLE AND THIADIAZOLE COMPOUNDS AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS NeuroSearch A/S (DK) 2009-07-22 EP disclosed
WO-2008049864-A1 OXADIAZOLE AND THIADIAZOLE COMPOUNDS AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR MODULATORS NEUROSEARCH A/S (DK) 2008-05-02 WO disclosed