SCHEMBL30720840

SCHEMBL30720840

CCCCc1nc(C(F)(F)F)c[nH]1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.38
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.34
PARP1 P09874 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 1/20 0.33
GPR84 Q9NQS5 2/20 0.32
FABP4 P15090 1/20 0.31
GSK3B P49841 1/20 0.31
DDX3X O00571 1/20 0.31

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
SCHEMBL5897349 0.95 ALDH1A1 (0.39) ALDH1A1PKMHPGDGPR84
SCHEMBL15778792 0.81 FABP4 (0.31) FABP4
SCHEMBL30720841 0.78 FABP4 (0.30) FABP4
SCHEMBL4314648 0.74
SCHEMBL3840247 0.73 HRH3 (0.42) HRH3ALDH1A1MAPK1PARP1PKM
SCHEMBL2037718 0.73 HRH3 (0.42) HRH3ALDH1A1MAPK1PARP1PKM
SCHEMBL7484116 0.73 FABP4 (0.31) PKMFABP4
SCHEMBL8801481 0.73 CACNA1H (0.40)
SCHEMBL6129194 0.72 TLR8 (0.45) HRH3ALDH1A1GSK3B
SCHEMBL8434648 0.72 HRH3 (0.46) HRH3ALDH1A1MAPK1PARP1PKM

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-4554933-A1 HERBICIDAL IMIDAZOLE COMPOUNDS Syngenta Crop Protection AG (CH) 2025-05-21 EP disclosed
CN-119451949-A Herbicidal imidazole compounds 先正达农作物保护股份公司 2025-02-14 CN disclosed
WO-2024013018-A1 HERBICIDAL IMIDAZOLE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2024-01-18 WO disclosed