SCHEMBL9821046

SCHEMBL9821046

CC(O)c1cc(F)cc(Br)c1F

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
GAA P10253 1/20 0.32
PDE2A O00408 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRB1 P18505 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
SCHEMBL25839081 0.83 GABRA1 (0.37) CES2CES1GABRA1GABRB1
SCHEMBL23526123 0.79 PDE2A (0.35) GAAPDE2A
SCHEMBL30014342 0.79 PDE2A (0.35) GAAPDE2A
SCHEMBL23526125 0.79 PDE2A (0.35) GAAPDE2A
SCHEMBL2001602 0.78 CES2 (0.52) CES2CES1PDE2A
SCHEMBL4099522 0.78 CES2 (0.52) CES2CES1PDE2A
SCHEMBL4101136 0.78 CES2 (0.52) CES2CES1PDE2A
SCHEMBL24458099 0.77 CES2 (0.34) CES2CES1PDE2A
SCHEMBL6744704 0.75 CES2 (0.37) CES2CES1PDE2AGABRA1GABRB1
SCHEMBL6742156 0.75 CES2 (0.37) CES2CES1PDE2AGABRA1GABRB1

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-0224001-B1 ANTHRANILONITRILE DERIVATIVES AND RELATED COMPOUNDS AS USEFUL AGENTS FOR PROMOTING GROWTH, IMPROVING FEED EFFICIENCY, AND FOR INCREASING THE LEAN MEAT TO FAT RATIO OF WARM-BLOODED ANIMALS AMERICAN CYANAMID COMPANY (US) 1991-03-20 EP disclosed
US-4863959-A Anthranilonitrile derivatives as useful agents for promoting growth, improving feed efficiency, and for increasing the lean meat to fat ratio of warm-blooded animals AMERICAN CYANAMID COMPANY (US) 1989-09-05 US disclosed
EP-0224001-A1 Anthranilonitrile derivatives and related compounds as useful agents for promoting growth, improving feed efficiency, and for increasing the lean meat to fat ratio of warm-blooded animals AMERICAN CYANAMID COMPANY (US) 1987-06-03 EP disclosed