SCHEMBL9407239

SCHEMBL9407239

CCOC(=O)Oc1nc(Cl)nc(Cl)c1Oc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
MAPT P10636 3/20 0.42
CYP1A2 P05177 3/20 0.40
POLB P06746 3/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
HPGD P15428 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
ALDH1A1 P00352 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SCN9A Q15858 1/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
KDM4E B2RXH2 2/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL9153563 0.80 MAPT (0.49) MAPTCYP1A2POLBCYP2C9CYP2C19
SCHEMBL37520 0.71 MAPT (0.56) ALOX5MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL8567536 0.67 CUL4A (0.39) ALOX5MAPTCYP1A2RAB9AHPGD
SCHEMBL16702759 0.67 ALDH1A1 (0.43) ALOX5MAPTCYP1A2NPC1HPGD
SCHEMBL27861489 0.66 MAPT (0.54) MAPTCYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL11118774 0.66 MAPT (0.48) ALOX5MAPTCYP1A2CYP2C9CYP2C19
SCHEMBL13195034 0.66 POLB (0.45) MAPTCYP1A2POLBCYP2C9CYP2C19
SCHEMBL9407230 0.66 POLB (0.45) ALOX5MAPTPOLBNPC1RAB9A
Urethane SCHEMBL21771895 0.65 ALOX15 (0.52) MAPTCYP1A2CYP2C9CYP2C19NPC1
SCHEMBL21991771 0.65 MMP2 (0.53) MAPTCYP1A2L3MBTL1NPC1RAB9A

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
EP-0601386-A1 Sulphonamides F. HOFFMANN-LA ROCHE AG (CH) 1994-06-15 EP disclosed