SCHEMBL8200836

SCHEMBL8200836

O=c1oc2cc(O)c(F)cc2s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.53
MAOA P21397 5/20 0.53
MAOB P27338 5/20 0.53
ALPI P09923 2/20 0.53
ALPG P10696 2/20 0.53
CA2 P00918 1/20 0.53
HPGD P15428 1/20 0.53
HTT P42858 1/20 0.53
KMT2A Q03164 5/20 0.43
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 3/20 0.43
ALOX15 P16050 3/20 0.43
ALOX12 P18054 3/20 0.43
HSD17B10 Q99714 3/20 0.43
TDP1 Q9NUW8 2/20 0.43
CUL4A Q13619 4/20 0.40
MEN1 O00255 3/20 0.36
GAA P10253 4/20 0.36
POLB P06746 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL24091291 0.84 MAPT (0.60) MAPTMAOAMAOBALPIALPG
SCHEMBL14030769 0.84 MAOA (0.50) MAPTMAOAMAOBALPIALPG
SCHEMBL6001543 0.78 CUL4A (0.54) MAPTMAOAMAOBALPIALPG
SCHEMBL6002101 0.78 CUL4A (0.54) MAPTMAOAMAOBALPIALPG
SCHEMBL8035971 0.75 MAOA (0.57) MAPTMAOAMAOBALPIALPG
SCHEMBL10397843 0.74 MAPT (0.49) MAPTMAOAMAOBALPIALPG
SCHEMBL996615 0.74 CA9 (0.50) MAPTMAOAMAOBALPIALPG
SCHEMBL8208234 0.70 CUL4A (0.47) MAPTMAOAMAOBALPIALPG
SCHEMBL1000191 0.70 MAPT (0.49) MAPTMAOAMAOBALPIALPG
Tioxolone SCHEMBL36433 0.69 MAOA (1.00) MAPTMAOAMAOBALPIALPG

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
US-6110961-A USEFUL IN PROPHYLAXIS AND TREATMENT OF MENTAL DISORDERS, SUCH AS DEPRESSION, ANXIETY KRENITSKY PHARMACEUTICALS, INC. (US) 2000-08-29 US disclosed