SCHEMBL13406262

SCHEMBL13406262

Cc1cc(Oc2c(I)cc(C(F)(F)F)cc2N=O)n[nH]1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.33
IKBKB O14920 1/20 0.32

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
SCHEMBL13325967 0.85 DHODH (0.33) DHODHIKBKB
SCHEMBL13406675 0.82 DHODH (0.36) DHODHIKBKB
SCHEMBL13325350 0.78 DHODH (0.40) DHODHIKBKB
SCHEMBL1531231 0.74 DHODH (0.40) DHODHIKBKB
SCHEMBL1531076 0.73 DHODH (0.39) DHODHIKBKB
SCHEMBL13326036 0.72 DHODH (0.38) DHODHIKBKB
SCHEMBL13325966 0.71 NPSR1 (0.35)
SCHEMBL13326044 0.70 AR (0.34) DHODH
SCHEMBL1531138 0.69 DHODH (0.36) DHODHIKBKB
SCHEMBL1531115 0.67 TDP1 (0.46)

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
US-7700786-B2 Pyrazole derivative, intermediate therefor, processes for producing these, and herbicide containing these as active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 2010-04-20 US disclosed