SCHEMBL3182256

SCHEMBL3182256

O=C(O)c1ccc2nc(-c3cccc(Cl)c3Cl)[nH]c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 8/20 0.60
TDP1 Q9NUW8 5/20 0.56
MAPT P10636 4/20 0.56
POLB P06746 3/20 0.56
TP53 P04637 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
NR4A2 P43354 1/20 0.54
F7 P08709 1/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
HDAC3 O15379 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HSP90AA1 P07900 1/20 0.51
ESR2 Q92731 1/20 0.51
DGAT1 O75907 1/20 0.51

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
SCHEMBL3172795 0.90 CHEK2 (0.65) CHEK2TDP1MAPTPOLBTP53
O-Tolylamine SCHEMBL4438621 0.88 NPC1 (0.54) CHEK2TDP1MAPTPOLBTP53
SCHEMBL1248424 0.85 DGAT1 (0.67) CHEK2TDP1MAPTPOLBTP53
SCHEMBL1250204 0.81 DGAT1 (0.64) CHEK2MAPTPOLBNPC1RAB9A
SCHEMBL3169464 0.81 CHEK2 (0.77) CHEK2TDP1MAPTPOLBTP53
SCHEMBL3169656 0.81 TDP1 (0.60) CHEK2TDP1MAPTPOLBTP53
SCHEMBL3183271 0.81 CHEK2 (0.68) CHEK2TDP1MAPTPOLBNR4A2
SCHEMBL3177289 0.80 NR4A2 (0.58) CHEK2TDP1MAPTPOLBTP53
SCHEMBL4011603 0.80 DGAT1 (0.57) CHEK2TDP1POLBNR4A2NPC1
SCHEMBL3172998 0.80 POLB (0.65) CHEK2TDP1MAPTPOLBTP53

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-2074089-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2009-07-01 EP claimed
WO-2008048991-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-04-24 WO claimed
EP-2074089-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2013-09-18 EP disclosed
US-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 US disclosed
US-20100016387-A1 METHOD OF TREATMENT BOSE AVIRUP 2010-01-21 US disclosed
EP-2101783-A2 METHOD OF PREVENTING OR TREATING MYOCARDIAL ISCHEMIA Novartis Ag (CH) 2009-09-23 EP disclosed
WO-2009112445-A1 METHOD OF INCREASING CELLULAR PHOSPHATIDYL CHOLINE BY DGAT1 INHIBITION NOVARTIS AG (CH) 2009-09-17 WO disclosed
EP-2074089-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2009-07-01 EP disclosed
WO-2008073865-A2 METHOD OF PREVENTING OR TREATING MYOCARDIAL ISCHEMIA NOVARTIS AG (CH) 2008-06-19 WO disclosed
WO-2008048991-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2008-04-24 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 (1 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-20100016387-A1 METHOD OF TREATMENT DGAT1, DGAT2, DGKA CHEK2 4425/4885TDP1 3086/4885MAPT 2619/4885

“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.