SCHEMBL9825807

SCHEMBL9825807

O=C1CC(c2ccccc2)Oc2ccc(F)cc21

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 16/20 0.78
AR P10275 3/20 0.69
CYP19A1 P11511 2/20 0.67
KDM4E B2RXH2 1/20 0.67
ADORA3 P0DMS8 1/20 0.67
HSD17B10 Q99714 1/20 0.67
ABCB1 P08183 1/20 0.64
ABCG2 Q9UNQ0 1/20 0.64
STS P08842 1/20 0.59
MAOA P21397 1/20 0.57
PSMB5 P28074 1/20 0.57

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
SCHEMBL10360962 0.88 MAOB (1.00) MAOBARCYP19A1KDM4EADORA3
SCHEMBL10360819 0.88 MAOB (1.00) MAOBARCYP19A1KDM4EADORA3
SCHEMBL6699546 0.84 AR (0.73) MAOBARCYP19A1KDM4EADORA3
SCHEMBL2474549 0.83 MAOB (1.00) MAOBARCYP19A1KDM4EADORA3
SCHEMBL2474548 0.83 MAOB (1.00) MAOBARCYP19A1KDM4EADORA3
SCHEMBL14053522 0.82 AR (0.74) MAOBARCYP19A1KDM4EADORA3
SCHEMBL7958829 0.82 AR (0.69) MAOBARCYP19A1KDM4EADORA3
SCHEMBL10362227 0.82 AR (1.00) MAOBARCYP19A1KDM4EADORA3
SCHEMBL1820312 0.82 MAOB (0.78) MAOBARCYP19A1KDM4EADORA3
SCHEMBL1820699 0.82 AR (0.74) MAOBARCYP19A1KDM4EADORA3

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0230379-B1 CHROMAN- AND THIOCHROMAN-4-ACETIC ACIDS USEFUL IN THE TREATMENT OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1991-04-03 EP disclosed
EP-0139614-B1 PHARMACEUTICAL PREPARATIONS CONTAINING FLAVANONE OR THIOFLAVANONE DERIVATIVES, THE USE THEREOF, NOVEL FLAVANONES AND THIOFLAVANONES, AND PROCESSES FOR THEIR MANUFACTURE Zyma SA (CH) 1990-08-22 EP disclosed
US-4935441-A Flavene and thioflavene derivates, processes for their manufacture, pharmaceutical preparations that contain such compounds, and the use of the latter ZYMA SA (CH) 1990-06-19 US disclosed
US-4885298-A Pharmaceutical preparations containing flavanone or thioflavanone derivatives the use thereof, novel flavanones and thioflavanones, and processes for their manufacture ZYMA SA (CH) 1989-12-05 US disclosed
US-4853410-A Hydroxyacetic acid derivatives for the treatment of diabetic complications PFIZER INC. (US) 1989-08-01 US disclosed
EP-0139615-B1 FLAVENE AND THIOFLAVENE DERIVATIVES, PROCESSES FOR THEIR MANUFACTURE, PHARMACEUTICAL PREPARATIONS THAT CONTAIN SUCH COMPOUNDS, AND THE USE OF THE LATTER Zyma SA (CH) 1989-04-19 EP disclosed
WO-1987004344-A1 HYDROXYACETIC ACID DERIVATIVES FOR THE TREATMENT OF DIABETIC COMPLICATIONS PFIZER INC. (US) 1987-07-30 WO disclosed
EP-0230379-A2 Chroman- and thiochroman-4-acetic acids useful in the treatment of diabetic complications PFIZER INC. (US) 1987-07-29 EP disclosed
EP-0139615-A2 Flavene and thioflavene derivatives, processes for their manufacture, pharmaceutical preparations that contain such compounds, and the use of the latter Zyma SA (CH) 1985-05-02 EP disclosed
EP-0139614-A2 Pharmaceutical preparations containing flavanone or thioflavanone derivatives, the use thereof, novel flavanones and thioflavanones, and processes for their manufacture Zyma SA (CH) 1985-05-02 EP disclosed