SCHEMBL15833862

SCHEMBL15833862

FC(F)(F)c1cc(CI)ccc1CBr

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 6/20 0.35
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
KIF11 P52732 1/20 0.31
MAOB P27338 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
PTPN7 P35236 1/20 0.30
DUSP3 P51452 1/20 0.30
LTA4H P09960 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
SCHEMBL699945 0.77 IDO1 (0.37) IDO1
SCHEMBL28465180 0.75 IDO1 (0.37) IDO1RXRARXRBRXRGKIF11
SCHEMBL29616489 0.75 IDO1 (0.59) IDO1SLC6A2SLC6A4SLC6A3
SCHEMBL29452391 0.75 KDM1A (0.43) IDO1SLC6A4PTPN7DUSP3
SCHEMBL195156 0.75 KDM1A (0.43) IDO1SLC6A4PTPN7DUSP3
SCHEMBL488748 0.75 IDO1 (0.59) IDO1SLC6A2SLC6A4SLC6A3
SCHEMBL627838 0.75 DAO (0.46) IDO1SLC6A4
SCHEMBL4550353 0.74 LOXL2 (0.41) IDO1RXRARXRBRXRGMAOB
SCHEMBL18921944 0.74 IDO1 (0.39) IDO1RXRARXRBRXRGMAOB
SCHEMBL14541391 0.73 IDO1 (0.61) IDO1MAOBSLC6A4

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
WO-2014100206-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-06-26 WO disclosed