SCHEMBL9821029

SCHEMBL9821029

CC(=O)c1cc(Cl)cc(C#N)c1F

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HPGD P15428 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 3/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPK1 P28482 1/20 0.35
USP7 Q93009 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
GRM4 Q14833 1/20 0.34
TMPRSS4 Q9NRS4 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL9821099 0.82 SMN1; SMN2 (0.44) KDM4ESMN1; SMN2HPGDCYP1A2CYP2C9
SCHEMBL2071742 0.81 KDM4E (0.43) KDM4ESMN1; SMN2HPGDL3MBTL1ALDH1A1
SCHEMBL14344995 0.79 KDM4E (0.39) KDM4ESMN1; SMN2HPGDCYP1A2CYP2C9
SCHEMBL16122649 0.77 KHK (0.41) HPGDALDH1A1CYP11B1CYP11B2
SCHEMBL30386258 0.76 AKR1C4 (0.44) SMN1; SMN2ALDH1A1MAPK1
SCHEMBL2532385 0.75 GABRA1 (0.46) KDM4ESMN1; SMN2L3MBTL1GAAUSP7
SCHEMBL22120040 0.72 ESR1 (0.39) HPGDALDH1A1CYP11B1CYP11B2
SCHEMBL22699844 0.72 EGLN2 (0.38) KDM4EHPGDALDH1A1MEN1KMT2A
SCHEMBL29555839 0.72 ESR1 (0.39) HPGDALDH1A1CYP11B1CYP11B2
SCHEMBL8221389 0.71 NOTUM (0.47) KDM4ESMN1; SMN2CYP1A2CYP2C9CYP2C19

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