SCHEMBL8350547

SCHEMBL8350547

[C-]#[N+]c1ccc(F)c(Cl)c1Cl

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.33
RIPK1 Q13546 1/20 0.33
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 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
SCHEMBL2741068 0.80
SCHEMBL9847889 0.76 TNF (0.46) TNFRIPK1HTR2AHTR2CHTR2B
SCHEMBL12138245 0.76
SCHEMBL8436824 0.75 CYP3A4 (0.40)
SCHEMBL2741053 0.73 TAAR1 (0.30)
SCHEMBL12138787 0.73 TAAR1 (0.30)
SCHEMBL12138789 0.73 TAAR1 (0.30)
SCHEMBL12190382 0.71 TP53 (0.35) HTR2AHTR2CHTR2B
SCHEMBL9624552 0.71 ALDH1A1 (0.32)
SCHEMBL4945016 0.71 NOTUM (0.34)

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
US-5981438-A HERBICIDE, INSECTICIDE AND PESTICIDE NIHON BAYER AGROCHEM K.K. (JP) 1999-11-09 US disclosed
EP-0855394-A1 1-Phenyl-5-anilinotetrazoles derivatives, their preparation and their use as microbiocides, insecticides and/or herbicides NIHON BAYER AGROCHEM K.K. (JP) 1998-07-29 EP disclosed