SCHEMBL6759895

SCHEMBL6759895

O=c1nc(-c2cc(Cl)ccc2O)oc2cccc(Cl)c12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
KDM6B O15054 1/20 0.45
KDM6A O15550 1/20 0.45
PTGS2 P35354 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ELANE P08246 4/20 0.41
EEF2K O00418 1/20 0.40
PLK4 O00444 1/20 0.40
IKBKB O14920 1/20 0.40
DYRK3 O43781 1/20 0.40
PIM1 P11309 1/20 0.40
CDK2 P24941 1/20 0.40
AKT1 P31749 1/20 0.40
AKT2 P31751 1/20 0.40
CLK2 P49760 1/20 0.40
GSK3B P49841 1/20 0.40
IRAK1 P51617 1/20 0.40
RPS6KA3 P51812 1/20 0.40

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
SCHEMBL6759892 0.82 HPGD (0.41) MAPTKDM6BKDM6AL3MBTL1MEN1
SCHEMBL6762328 0.81 MAOA (0.48) MAPTKDM6BKDM6AL3MBTL1MEN1
SCHEMBL13522796 0.77 KDM6B (0.73) MAPTKDM6BKDM6APTGS2L3MBTL1
SCHEMBL13522992 0.74 NPC1 (0.61) MAPTKDM6BKDM6AMEN1KMT2A
SCHEMBL6469733 0.73 MAOA (0.49) MAPTKDM6BKDM6APTGS2MEN1
SCHEMBL6469479 0.73 MAOA (0.59) MAPTKDM6BKDM6APTGS2MEN1
SCHEMBL10590299 0.70 AGPAT2 (0.50) MAPTSMN1; SMN2TP53
SCHEMBL13522990 0.69 KDM4E (0.49) MAPTKDM6BKDM6APTGS2L3MBTL1
SCHEMBL16348348 0.68 EPHX2 (0.44) MAPTKDM6BKDM6APIM1CDK5
SCHEMBL16203168 0.68 KDM6B (0.67) MAPTKDM6BKDM6AL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6723742-B2 TREATMENT OF DISEASES WHICH CAUSE EXCESS OF IRON IN HUMAN OR ANIMAL BODY OR ARE CAUSED BY IT NOVARTIS AG. (CH) 2004-04-20 US disclosed
US-20030203954-A1 Substituted 3, 5-diphenyl-1,2,4-triazoles and their use as pharmaceutical metal chelators LATTMANN RENE (CH) 2003-10-30 US disclosed
US-6596750-B2 Compounds have useful pharmaceutical properties and are particularly active as iron chelators. They can be used for the treatment of iron overload in warm-blooded animals. NOVARTIS AG (CH) 2003-07-22 US disclosed
US-20030069273-A1 Substituted 3,5-diphenyl-1,2,4-triazoles and their use as pharmaceutical metal chelators LATTMANN RENE (CH) 2003-04-10 US disclosed
EP-0914118-B1 SUBSTITUTED 3,5-DIPHENYL-1,2,4-TRIAZOLES AND THEIR USE AS PHARMACEUTICAL METAL CHELATORS NOVARTIS AG (CH) 2002-10-23 EP disclosed
US-6465504-B1 Substituted 3,5-diphenyl-1,2,4-triazoles and their use as pharmaceutical metal chelators NOVARTIS AG (CH) 2002-10-15 US disclosed
EP-0914118-A1 SUBSTITUTED 3,5-DIPHENYL-1,2,4-TRIAZOLES AND THEIR USE AS PHARMACEUTICAL METAL CHELATORS Novartis AG (CH) 1999-05-12 EP disclosed
WO-1997049395-A1 SUBSTITUTED 3,5-DIPHENYL-1,2,4-TRIAZOLES AND THEIR USE AS PHARMACEUTICAL METAL CHELATORS NOVARTIS-ERFINDUNGEN VERWALTUNGSGESELLSCHAFT M.B.H. (AT) 1997-12-31 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030069273-A1 Substituted 3,5-diphenyl-1,2,4-triazoles and their use as pharmaceutical metal chelators TFRC, SLC40A1, FECH MAPT 3676/4885KDM6B 2804/4885KDM6A 2279/4885
US-20030203954-A1 Substituted 3, 5-diphenyl-1,2,4-triazoles and their use as pharmaceutical metal chelators TFRC, SLC40A1, FECH MAPT 3676/4885KDM6B 2804/4885KDM6A 2279/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.