SCHEMBL7891019

SCHEMBL7891019

Cc1c(C(F)(F)F)n(C)c(=O)n(-c2cc(OC(C)C)c(Br)cc2F)c1=O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.35
BTK Q06187 2/20 0.35
PPOX P50336 2/20 0.31
DHODH Q02127 5/20 0.31
RXFP1 Q9HBX9 1/20 0.30
BCAT1 P54687 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
SCHEMBL7888644 0.82 JAK2 (0.33) JAK2BTK
SCHEMBL7881722 0.81 BCAT1 (0.32) PPOXDHODHBCAT1
SCHEMBL7891153 0.81 BCAT2 (0.30) BCAT1
SCHEMBL7881999 0.79 MAPT (0.41) JAK2BTKRXFP1
SCHEMBL30285960 0.78 DHODH (0.33) JAK2BTKDHODHBCAT1
SCHEMBL30285924 0.78 DHODH (0.33) JAK2BTKDHODHBCAT1
SCHEMBL10575119 0.77 PPOX (0.45) PPOXDHODH
SCHEMBL10577166 0.76 PPOX (0.44) PPOXDHODH
SCHEMBL7891215 0.76 RXFP1 (0.50) JAK2BTKRXFP1
SCHEMBL9710897 0.75 PPOX (0.32) JAK2BTKPPOX

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
US-6174839-B1 AS HERBICIDE NIHON BAYER AGROCHEM K.K. (JP) 2001-01-16 US disclosed
US-5935907-A HERBICIDES NIHON BAYER AGROCHEM K.K. (JP) 1999-08-10 US disclosed
EP-0869123-A2 Phenylacetylene derivatives NIHON BAYER AGROCHEM K.K. (JP) 1998-10-07 EP disclosed