SCHEMBL9821154

SCHEMBL9821154

CC(C)(C)NCC(O)c1ccc(N)c(C#N)c1F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 4/20 0.43
ADRB1 P08588 4/20 0.43
HIF1A Q16665 2/20 0.43
CYP2D6 P10635 1/20 0.43
NFKB1 P19838 1/20 0.43
BLM P54132 1/20 0.43
LMNA P02545 3/20 0.40
TSHR P16473 3/20 0.40
ADRA1A P35348 2/20 0.40
HTR1A P08908 2/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
OPRK1 P41145 1/20 0.40
SLC6A3 Q01959 1/20 0.40
CYP3A4 P08684 3/20 0.39
KDM4E B2RXH2 1/20 0.39
ADRA2A P08913 2/20 0.38
ADRA2B P18089 2/20 0.38
ADRA2C P18825 1/20 0.38
MAOA P21397 1/20 0.37

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
SCHEMBL9821055 0.85 ADRB1 (0.49) ADRB2ADRB1HIF1ACYP2D6NFKB1
SCHEMBL9821020 0.84 ADRB2 (0.49) ADRB2ADRB1HIF1ACYP2D6NFKB1
SCHEMBL9820981 0.84 ADRB1 (0.42) ADRB2ADRB1HIF1ACYP2D6NFKB1
SCHEMBL9820983 0.82 ADRB2 (0.56) ADRB2ADRB1HIF1ATSHRADRA1A
SCHEMBL9821102 0.82 ADRB1 (0.40) ADRB2ADRB1HIF1ACYP2D6NFKB1
SCHEMBL9820963 0.82 LMNA (0.44) ADRB2ADRB1HIF1ACYP2D6NFKB1
SCHEMBL10534049 0.81 ADRB2 (0.43) ADRB2ADRB1HIF1ACYP2D6NFKB1
SCHEMBL9821184 0.79 ADRB1 (0.38) ADRB2ADRB1HIF1ACYP2D6NFKB1
SCHEMBL20819681 0.79 ADRB2 (0.49) ADRB2ADRB1HIF1ACYP2D6NFKB1
SCHEMBL20833675 0.79 ADRB2 (0.49) ADRB2ADRB1HIF1ACYP2D6NFKB1

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 5 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 claimed
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 claimed
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